| Year |
Citation |
Score |
| 2016 |
Durig JR, Fausto R, Ünsalan O, Bayarı S, Kuş N, Ildız GÖ. Molecular spectroscopy and molecular structure - Selected communications presented at the 1st International Turkish Congress on Molecular Spectroscopy (TURCMOS 2013). Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 152: 523-4. PMID 26183526 DOI: 10.1016/J.Saa.2015.06.085 |
0.305 |
|
| 2015 |
Guirgis GA, Sawant DK, Brenner RE, Deodhar BS, Seifert NA, Geboes Y, Pate BH, Herrebout WA, Hickman DV, Durig JR. Microwave, r0 Structural Parameters, Conformational Stability and Vibrational Assignment of (Chloromethyl)fluorosilane. The Journal of Physical Chemistry. A. PMID 26436757 DOI: 10.1021/Acs.Jpca.5B06679 |
0.681 |
|
| 2015 |
Sawant DK, Klaassen JJ, Gounev TK, Durig JR. R0 Structural parameters, conformational, vibrational studies and ab initio calculations of cyanocyclopentane. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 151: 468-79. PMID 26151436 DOI: 10.1016/J.Saa.2015.06.116 |
0.893 |
|
| 2015 |
Deodhar BS, Brenner RE, Klaassen JJ, Tubergen MJ, Durig JR. Microwave, structural, conformational, vibrational studies and ab initio calculations of fluoroacetyl chloride. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 148: 289-98. PMID 25909903 DOI: 10.1016/J.Saa.2015.04.007 |
0.874 |
|
| 2015 |
Darkhalil ID, Paquet C, Waqas M, Gounev TK, Durig JR. Conformational stability, r(0) structural parameters, vibrational assignments and ab initio calculations of ethyldichlorophosphine. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 136: 42-50. PMID 24618201 DOI: 10.1016/J.Saa.2014.01.039 |
0.742 |
|
| 2015 |
Durig JR, Klaassen JJ, Sawant DK, Deodhar BS, Panikar SS, Gurusinghe RM, Darkhalil ID, Tubergen MJ. Microwave, structural, conformational, vibrational studies and ab initio calculations of isocyanocyclopentane. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 136: 3-15. PMID 24480667 DOI: 10.1016/J.Saa.2013.12.078 |
0.917 |
|
| 2015 |
Deodhar BS, Brenner RE, Sawant DK, Guirgis GA, Geboes Y, Herrebout WA, Durig JR. Vibrational assignments and conformer stability determination of cyclobutyldichlorosilane by variable temperature Raman spectra in krypton solution Vibrational Spectroscopy. 81: 119-130. DOI: 10.1016/J.Vibspec.2015.10.009 |
0.662 |
|
| 2015 |
Durig JR, Deodhar BS, Zhou SX, Herrebout W, Dom JJ, van der Veken BJ, Gounev TK. Raman, infrared and microwave spectra, r0 structural parameters, and conformational stability of isopropylisocyanate Journal of Molecular Structure. 1099: 163-173. DOI: 10.1016/J.Molstruc.2015.05.031 |
0.73 |
|
| 2015 |
Darkhalil ID, Klaassen JJ, Deodhar BS, Gounev TK, Durig JR. Conformational stability, infrared and Raman spectra, vibrational assignments, and theoretical calculations of cyclohexylamine Journal of Molecular Structure. 1088: 169-178. DOI: 10.1016/J.Molstruc.2015.02.007 |
0.867 |
|
| 2014 |
Darkhalil ID, Nagels N, Herrebout WA, Van Der Veken BJ, Gurusinghe RM, Tubergen MJ, Durig JR. Microwave spectra and conformational studies of ethylamine from temperature dependent Raman spectra of xenon solutions and ab initio calculations Journal of Molecular Structure. 1068: 101-111. DOI: 10.1016/J.Molstruc.2014.03.073 |
0.733 |
|
| 2014 |
Sawant DK, Klaassen JJ, Panikar SS, Durig JR. Infrared and Raman spectra, adjusted r0 structural parameters, and vibrational assignment of isopropyl isocyanide Journal of Molecular Structure. 1073: 112-118. DOI: 10.1016/J.Molstruc.2014.03.072 |
0.874 |
|
| 2014 |
Durig JR, Guirgis GA, Sawant DK, Seifert NA, Deodhar BS, Pate BH, Panikar SS, Groner P, Overby JS, Askarian SM. Microwave, r0 structural parameters, conformational stability and vibrational assignment of cyclopropylcyanosilane Chemical Physics. 445: 68-81. DOI: 10.1016/J.Chemphys.2014.10.004 |
0.873 |
|
| 2014 |
Darkhalil ID, Klaassen JJ, Nagels N, Herrebout WA, Van Der Veken BJ, Gurusinghe RM, Tubergen MJ, Durig JR. Raman and infrared, microwave spectra, conformational stability, adjusted r0 structural parameters, and vibrational assignments of cyclopentylamine Journal of Raman Spectroscopy. 45: 392-406. DOI: 10.1002/Jrs.4467 |
0.869 |
|
| 2013 |
Klaassen JJ, Darkhalil ID, Deodhar BS, Gounev TK, Gurusinghe RM, Tubergen MJ, Groner P, Durig JR. Microwave and infrared spectra, adjusted r0 structural parameters, conformational stabilities, vibrational assignments, and theoretical calculations of cyclobutylcarboxylic acid chloride. The Journal of Physical Chemistry. A. 117: 6508-24. PMID 23777483 DOI: 10.1021/Jp404510N |
0.843 |
|
| 2013 |
Panikar SS, Deodhar BS, Sawant DK, Klaassen JJ, Deng J, Durig JR. Raman and infrared spectra, r₀ structural parameters, and vibrational assignments of (CH₃)₂PX where X=H, CN, and Cl. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 103: 205-15. PMID 23261615 DOI: 10.1016/J.Saa.2012.10.032 |
0.876 |
|
| 2013 |
Guirgis GA, Klaassen JJ, Pate BH, Seifert NA, Darkhalil ID, Deodhar BS, Wyatt JK, Dukes HW, Kruger M, Durig JR. Microwave, infrared, and Raman spectra, structural parameters, vibrational assignments and theoretical calculations of 1,3-disilacyclopentane Journal of Molecular Structure. 1049: 400-408. DOI: 10.1016/J.Molstruc.2013.06.042 |
0.856 |
|
| 2013 |
Durig JR, Klaassen JJ, Deodhar BS, Darkhalil ID, Herrebout WA, Dom JJJ, Van Der Veken BJ, Purohita SS, Guirgis GA. Conformational and structural studies of ethynylcyclopentane from temperature dependent Raman spectra of xenon solutions, infrared spectra, and ab initio calculations Journal of Molecular Structure. 1044: 10-20. DOI: 10.1016/J.Molstruc.2012.12.046 |
0.875 |
|
| 2013 |
Klaassen JJ, Panikar SS, Guirgis GA, Dukes HW, Wyatt JK, Durig JR. Conformational and structural studies of cyclobutylsilane from temperature dependent infrared spectra of xenon solutions and ab initio calculations Journal of Molecular Structure. 1032: 254-264. DOI: 10.1016/J.Molstruc.2012.09.014 |
0.918 |
|
| 2013 |
Durig JR, Panikar SS, Purohit SS, Pai TH, Kalasinsky VF. Conformational stabilities from variable temperature Raman spectra, r 0 structural parameters and vibrational assignments of 1,2-diphosphinoethane Journal of Molecular Structure. 1033: 19-26. DOI: 10.1016/J.Molstruc.2012.04.036 |
0.893 |
|
| 2013 |
Pate BH, Seifert NA, Guirgis GA, Deodhar BS, Klaassen JJ, Darkhalil ID, Crow JA, Wyatt JK, Dukes HW, Durig JR. Microwave, infrared, and Raman spectra, structural parameters, vibrational assignments and theoretical calculations of 1,1,3,3-tetrafluoro-1,3- disilacyclopentane Chemical Physics. 416: 33-42. DOI: 10.1016/J.Chemphys.2013.03.002 |
0.753 |
|
| 2013 |
Panikar SS, Guirgis GA, Eddens MT, Dukes HW, Conrad AR, Tubergen MJ, Gounev TK, Durig JR. Microwave, infrared and Raman spectra, adjusted r0 structural parameters, conformational stability, and vibrational assignment of cyclopropylfluorosilane Chemical Physics. 415: 124-132. DOI: 10.1016/J.Chemphys.2012.12.036 |
0.841 |
|
| 2013 |
Zhou SX, Ward RM, Tubergen MJ, Gurusinghe RM, Durig JR. Microwave, infrared, and Raman spectra, r0 structural parameters, conformational stability and ab initio calculations of cyclohexylisocyanate Chemical Physics. 415: 44-55. DOI: 10.1016/J.Chemphys.2012.12.013 |
0.754 |
|
| 2013 |
Zhou SX, Guirgis GA, Gause KK, Conrad AR, Tubergen MJ, Durig JR. Microwave, Raman and infrared spectra, r0 structural parameters, conformational stability, and ab initio calculations of cyclobutylisocyanate Structural Chemistry. 24: 201-214. DOI: 10.1007/S11224-012-0066-3 |
0.754 |
|
| 2012 |
Guirgis GA, Klaassen JJ, Deodhar BS, Sawant DK, Panikar SS, Dukes HW, Wyatt JK, Durig JR. Structure and conformation studies from temperature dependent infrared spectra of xenon solutions and ab initio calculations of cyclobutylgermane. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 99: 266-78. PMID 23085284 DOI: 10.1016/J.Saa.2012.09.038 |
0.897 |
|
| 2012 |
Panikar SS, Guirgis GA, Sheehan TG, Durig DT, Durig JR. Infrared spectra, vibrational assignment, and ab initio calculations for N-bromo-hexafluoro-2-propanimine. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 90: 118-24. PMID 22336042 DOI: 10.1016/J.Saa.2012.01.007 |
0.847 |
|
| 2012 |
Durig JR, Panikar SS, Obenchain DA, Bills BJ, Lohan PM, Peebles RA, Peebles SA, Groner P, Guirgis GA, Johnston MD. Microwave, infrared and Raman spectra, r0 structural parameters, ab initio calculations and vibrational assignment of 1-fluoro-1-silacyclopentane. The Journal of Chemical Physics. 136: 044306. PMID 22299870 DOI: 10.1063/1.3673889 |
0.821 |
|
| 2012 |
Durig JR, Klaassen JJ, Deodhar BS, Gounev TK, Conrad AR, Tubergen MJ. Microwave, infrared, and Raman spectra, r0 structural parameters, conformational stability, and vibrational assignment of allyl thiol. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 87: 214-27. PMID 22178242 DOI: 10.1016/J.Saa.2011.11.041 |
0.849 |
|
| 2012 |
Durig JR, Darkhalil ID, Klaassen JJ. Infrared and Raman spectra, r 0 structural parameters, conformational stability, and vibrational assignment of 2-cyanoethylamine Journal of Molecular Structure. 1023: 154-162. DOI: 10.1016/J.Molstruc.2012.03.067 |
0.853 |
|
| 2012 |
Durig JR, Klaassen JJ, Darkhalil ID, Herrebout WA, Dom JJJ, Van Der Veken BJ. Conformational and structural studies of isopropylamine from temperature dependent Raman spectra of xenon solutions and ab initio calculations Journal of Molecular Structure. 1009: 30-41. DOI: 10.1016/J.Molstruc.2011.07.026 |
0.892 |
|
| 2012 |
Durig JR, Panikar SS, Pai TH, Zhou CX, Kalasinsky VF, Purohit SS. Infrared and Raman spectra, structural parameters, conformational stability, vibrational assignment and ab initio calculations of 2-cyanoethylphosphine Chemical Physics. 405: 1-8. DOI: 10.1016/J.Chemphys.2012.01.029 |
0.841 |
|
| 2012 |
Durig JR, Darkhalil ID, Klaassen JJ, Herrebout WA, Dom JJJ, Van Der Veken BJ. Conformational and structural studies of n-propylamine from temperature dependent Raman and far infrared spectra of xenon solutions and ab initio calculations Journal of Raman Spectroscopy. 43: 1329-1336. DOI: 10.1002/Jrs.3163 |
0.861 |
|
| 2012 |
Guirgis GA, Darkhalil ID, Klaassen JJ, Ganguly A, Wyatt JK, Durig JR. Conformational, vibrational, and structural studies of 2,2,3,3,3- pentafluoropropylamine from Raman and infrared spectra of gas, liquid, xenon solutions, and solid supported by ab initio calculations Journal of Raman Spectroscopy. 43: 116-126. DOI: 10.1002/Jrs.2993 |
0.902 |
|
| 2011 |
Guirgis GA, Panikar SS, Klaassen JJ, Purohit SS, Johnston MD, Durig JR. Infrared and Raman spectra, ab initio calculations, conformational stability and vibrational assignment of 1-bromo-1-silacyclopentane. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 79: 858-66. PMID 21689977 DOI: 10.1016/J.Saa.2011.02.048 |
0.898 |
|
| 2011 |
Durig JR, El-Defrawy AM, Ganguly A, Panikar SS, Soliman MS. Conformational stability from variable-temperature infrared spectra of xenon solutions, r0 structural parameters, and vibrational assignment of pyrrolidine. The Journal of Physical Chemistry. A. 115: 7473-83. PMID 21619013 DOI: 10.1021/Jp200692T |
0.837 |
|
| 2011 |
Durig JR, Zhou SX, Guirgis GA, Wurrey CJ. Conformational stability from variable temperature infrared spectra of xenon solutions, r0 structural parameters, and ab initio calculations of cyclopropylisocyanate. The Journal of Physical Chemistry. A. 115: 2297-307. PMID 21366209 DOI: 10.1021/Jp108879U |
0.703 |
|
| 2011 |
Ganguly A, Klaassen JJ, Guirgis GA, Gounev TK, Durig JR. Conformational stability, r0 structural parameters, and vibrational assignments of mono-substituted cyclobutanes: fluorocyclobutane. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 79: 831-40. PMID 21030298 DOI: 10.1016/J.Saa.2010.08.082 |
0.848 |
|
| 2011 |
Durig JR, Panikar SS, Glenn KA, Zheng YY, Guirgis GA. Infrared and Raman spectra, conformational stability and vibrational assignment of 1-chloro-1-silacyclopentane Vibrational Spectroscopy. 55: 250-257. DOI: 10.1016/J.Vibspec.2010.12.003 |
0.882 |
|
| 2011 |
Durig JR, Deeb H, Darkhalil ID, Klaassen JJ, Gounev TK, Ganguly A. The r0 structural parameters, conformational stability, barriers to internal rotation, and vibrational assignments for trans and gauche ethanol Journal of Molecular Structure. 985: 202-210. DOI: 10.1016/J.Molstruc.2010.10.043 |
0.897 |
|
| 2011 |
Durig JR, Klaassen JJ, Panikar SS, Darkhalil ID, Ganguly A, Guirgis GA. Conformational and structural studies of 2,2-difluoroethylamine from temperature dependent infrared spectra of xenon solution and ab initio calculations Journal of Molecular Structure. 993: 73-85. DOI: 10.1016/J.Molstruc.2010.10.028 |
0.902 |
|
| 2010 |
Durig JR, Ward RM, Conrad AR, Tubergen MJ, Guirgis GA. Microwave, Raman, and infrared spectra; adjusted r(0) structural parameters; conformational stability; and vibrational assignment of germylcyclohexane. The Journal of Physical Chemistry. A. 114: 9289-99. PMID 20681535 DOI: 10.1021/Jp104207V |
0.466 |
|
| 2010 |
Durig JR, Panikar SS, Groner P, Nanaie H, Bürger H, Moritz P. Microwave spectrum, r(0) structure, dipole moment, barrier to internal rotation, and Ab initio calculations for fluoromethylsilane. The Journal of Physical Chemistry. A. 114: 4131-7. PMID 20199043 DOI: 10.1021/Jp911614D |
0.833 |
|
| 2010 |
Panikar SS, Kalasinsky VF, Pai TH, Durig JR. Conformational stabilities from variable temperature Raman spectra, r 0 structural parameters, and assignments of 1,2-diphosphinoethane Aip Conference Proceedings. 1267: 726-727. DOI: 10.1063/1.3482775 |
0.797 |
|
| 2010 |
Durig JR, Ward RM, Ganguly A, El Defrawy AM, Nelson KG, Gounev TK, Soliman MS, Guirgis GA. Conformational stability, r0 structural parameters, ab initio calculations, and vibrational assignment for cyanocyclopentane Vibrational Spectroscopy. 53: 45-53. DOI: 10.1016/J.Vibspec.2010.01.022 |
0.797 |
|
| 2010 |
Durig JR, Panikar SS, Iwata T, Gounev TK. Conformational stability of ethylenediamine from temperature dependent infrared spectra of liquid xenon solutions, r0 structural parameters, ab initio calculations, and vibrational assignments Journal of Molecular Structure. 984: 58-67. DOI: 10.1016/J.Molstruc.2010.09.007 |
0.899 |
|
| 2010 |
Murray JM, Serafin MM, Steber AL, Peebles SA, Peebles RA, Wurrey CJ, Durig JR, Guirgis GA. Rotational spectrum of five isotopologues of cyclopropylmethylgermane: Ab initio calculations, barrier to internal rotation and nuclear quadrupole coupling constants for the 73Ge nucleus Journal of Molecular Structure. 981: 54-58. DOI: 10.1016/J.Molstruc.2010.07.024 |
0.495 |
|
| 2010 |
Durig JR, Ward RM, Conrad AR, Tubergen MJ, Nelson KG, Gounev TK. Microwave, infrared, and Raman spectra, r0 structural parameters, conformational stability, and vibrational assignment of ethynylcyclohexane Journal of Molecular Structure. 975: 5-16. DOI: 10.1016/J.Molstruc.2010.03.040 |
0.754 |
|
| 2010 |
Durig JR, Zhou SX, Zheng C, Durig DT. Conformational stability, structural parameters and vibrational assignment from variable temperature infrared spectra of xenon and krypton solutions and ab initio calculations of ethylisocyanate Journal of Molecular Structure. 971: 23-32. DOI: 10.1016/J.Molstruc.2010.02.066 |
0.782 |
|
| 2010 |
Durig JR, Ward RM, Nelson KG, Gounev TK. Conformational stability from variable temperature infrared spectra of xenon solution, r0 structural parameters, and vibrational assignment of fluorocyclohexane Journal of Molecular Structure. 976: 150-160. DOI: 10.1016/J.Molstruc.2010.01.058 |
0.72 |
|
| 2010 |
Durig JR, Ganguly A, Zheng C, Gurigis G, Herrebout W, van der Veken B, Gounev TK. Conformational and structural studies of 2-fluoroethylamine from temperature dependent FT-IR spectra of krypton and xenon solutions and ab initio calculations Journal of Molecular Structure. 968: 36-47. DOI: 10.1016/J.Molstruc.2010.01.017 |
0.83 |
|
| 2010 |
Durig JR, Ward RM, Conrad AR, Tubergen MJ, Nelson KG, Groner P, Gounev TK. Microwave, Raman, and infrared spectra, r0 structural parameters, conformational stability, and vibrational assignment of cyanocyclohexane Journal of Molecular Structure. 967: 99-111. DOI: 10.1016/J.Molstruc.2009.12.046 |
0.744 |
|
| 2010 |
Durig JR, Zhou SX, Zhou CX, Durig NE. Structural parameters, vibrational spectra and centrifugal distortion constants of F(CN)C{double bond, long}NX (X = H, F, Cl, Br) and CH3(Y)C{double bond, long}NH (Y = H, CN) Journal of Molecular Structure. 967: 1-14. DOI: 10.1016/J.Molstruc.2009.12.004 |
0.488 |
|
| 2010 |
Guirgis GA, Zhou SX, Durig JR. Raman and infrared spectra, conformational stability, ab initio calculations and vibrational assignment of dimethylsilylisocyanate Journal of Raman Spectroscopy. 41: 303-309. DOI: 10.1002/Jrs.2423 |
0.708 |
|
| 2010 |
GUIRGIS GA, QTAITAT MA, MOHAMED T, SULLIVAN JF, DURIG JR. ChemInform Abstract: Conformational Stability from Low-Temperature FT-IR Spectra of Xenon Solutions of Some Vinylchlorosilanes Cheminform. 28: no-no. DOI: 10.1002/chin.199750333 |
0.403 |
|
| 2010 |
ROBB JBI, DURIG JR. ChemInform Abstract: Conformational Stabilities from Temperature-Dependent FT-IR Spectra of Xenon Solutions of Some Et-PR2 Molecules Cheminform. 28: no-no. DOI: 10.1002/chin.199750332 |
0.391 |
|
| 2010 |
CHATTERJEE KK, DURIG JR. ChemInform Abstract: Spectra and Structure of Organophosphorus Compounds. Part 49. Microwave, IR, and Raman Spectra, Electric Dipole Moment, Molecular Structure, and ab initio Calculations of Dimethylphosphonothioic Fluoride. Cheminform. 26: no-no. DOI: 10.1002/chin.199515048 |
0.471 |
|
| 2010 |
DURIG JR, COSTNER TG, WANG A, FRIERSON G, DURIG DT. ChemInform Abstract: Raman and Infrared Spectra, Conformational Stability, Barriers to Internal Rotation, Vibrational Assignment and ab initio Calculations of trans-1-Chloro-2-butene. Cheminform. 25: no-no. DOI: 10.1002/chin.199409034 |
0.599 |
|
| 2010 |
VAN DER VEKEN BJ, LIN J, DURIG JR. ChemInform Abstract: Raman and Infrared Spectra, Conformational Stability, Barriers to Internal Rotation, r0 Structural Parameters, ab initio Calculations, and Vibrational Assignment for Vinyl Chloroformate. Cheminform. 24: no-no. DOI: 10.1002/chin.199343052 |
0.589 |
|
| 2010 |
VAN DER VEKEN BJ, COPPENS P, SANDERS RS, DAEYAERT FF, DURIG JR. ChemInform Abstract: Spectra and Structure of Organophosphorus Compounds. Part 45. Vibrational Spectra, Conformational Stability, ab initio Calculations and Vibrational Assignment of Chloromethyl Difluorophosphine and Chloromethyl Difluorophosphine-d2. Cheminform. 24: no-no. DOI: 10.1002/chin.199306039 |
0.565 |
|
| 2010 |
DURIG JR, LIU J, LITTLE TS, KALASINSKY VF. ChemInform Abstract: Conformational Analysis, Barriers to Internal Rotation, Vibrational Assignment, and ab initio Calculations of 1,2-Difluoroethane. Cheminform. 24: no-no. DOI: 10.1002/chin.199305053 |
0.553 |
|
| 2010 |
DURIG JR, GUIRGIS GA, BREWER WE, BARANOVIC G. ChemInform Abstract: Microwave, IR, and Raman Spectra, Conformational Stability, Structural Parameters, Vibrational Assignment, and ab initio Calculations for 2- Methylpropionyl Fluoride. Cheminform. 24: no-no. DOI: 10.1002/chin.199301049 |
0.588 |
|
| 2010 |
GRONER P, DURIG JR. ChemInform Abstract: Molecular Dynamics of Organonitrogen Compounds from Rotational and Vibrational Spectroscopy Cheminform. 23: no-no. DOI: 10.1002/chin.199243313 |
0.304 |
|
| 2010 |
DURIG JR, BARRON DA, SULLIVAN JF, ANDERSON DG, CRADOCK S, RANKIN DWH. ChemInform Abstract: Conformational Stability and Molecular Structure of Dimethyl( methylthio)phosphine from Electron Diffraction Studies and ab initio Calculations. Cheminform. 23: no-no. DOI: 10.1002/chin.199233049 |
0.394 |
|
| 2010 |
DURIG JR, HIZER TJ, HARLAN RJ. ChemInform Abstract: Spectra and Structure of Organo-Phosphorus Compounds. Part 44. Conformational Stability, Barriers to Internal Rotation, Vibrational Assignment, and ab initio Calculations for Ethylphosphonic Difluoride. Cheminform. 23: no-no. DOI: 10.1002/chin.199222031 |
0.553 |
|
| 2010 |
CHATTERJEE KK, DURIG JR, BELL S. ChemInform Abstract: Microwave Spectrum, r0 Structure, and ab initio Calculations for Trimethylphosphine. Cheminform. 23: no-no. DOI: 10.1002/chin.199216044 |
0.414 |
|
| 2010 |
DURIG JR, GUIRGIS GA, BREWER WE, LITTLE TS. ChemInform Abstract: Vibrational Spectra and Structure, ab initio Calculations, and Conformational Stability of 2-Methylpropanal. Cheminform. 22: no-no. DOI: 10.1002/chin.199143036 |
0.575 |
|
| 2010 |
DURIG JR, LIU J, LITTLE TS. ChemInform Abstract: Conformational Stability, Far Infrared Spectra, Barriers to Internal Rotation, Vibrational Assignment and RHF/STO-3G* Calculations of 1-Bromo-2-fluoroethane. Cheminform. 22: no-no. DOI: 10.1002/chin.199143035 |
0.58 |
|
| 2010 |
DURIG JR, LIU J, LITTLE TS. ChemInform Abstract: Conformational Analysis, Barriers to Internal Rotation, ab initio Calculations, and Vibrational Assignment of 1-Chloro-2-fluoroethane Cheminform. 22: no-no. DOI: 10.1002/chin.199137049 |
0.558 |
|
| 2010 |
DURIG JR, QIU HZ, DURIG DT, ZHEN M, LITTLE TS. ChemInform Abstract: Microwave, IR, and Raman Spectra, Conformational Stability, Barriers to Internal Rotation, ab initio Calculations, and Vibrational Assignment of 3-Fluoro-2-methylpropene. Cheminform. 22: no-no. DOI: 10.1002/chin.199130043 |
0.59 |
|
| 2010 |
GRONER P, LEE MJ, DURIG JR. ChemInform Abstract: The Microwave Spectrum of the Equatorial Conformer of Chlorocyclopentane Cheminform. 22: no-no. DOI: 10.1002/chin.199129034 |
0.428 |
|
| 2010 |
DURIG JR, GUIRGIS GA, PHAN HV. ChemInform Abstract: Far-IR Spectrum, Conformational Stability, Barriers to Internal Rotation, ab initio Calculations, and Vibrational Assignment of Propionyl Bromide. Cheminform. 22: no-no. DOI: 10.1002/chin.199127050 |
0.57 |
|
| 2010 |
DURIG JR, WANG A, LITTLE TS. ChemInform Abstract: Far-IR Spectrum, Barriers to Internal Rotation, Structural Parameters, and Vibrational Assignment of Cyclopropylcarbonyl Fluoride. Cheminform. 22: no-no. DOI: 10.1002/chin.199127049 |
0.455 |
|
| 2010 |
ANDERSON DG, CRADOCK S, FORSYTH GA, RANKIN DWH, SULLIVAN JF, HIZER TJ, DURIG JR. ChemInform Abstract: Determination of the Molecular Structure of Ethylphosphonothioic Dichloride by Gas-Phase Electron Diffraction and ab initio Calculations. Cheminform. 22: no-no. DOI: 10.1002/chin.199127048 |
0.3 |
|
| 2010 |
DURIG JR, LEE MJ, LITTLE TS. ChemInform Abstract: Spectra and Structure of Small Ring Compounds. Part 58. Structural Parameters for Chlorocyclobutane from Combined Microwave Data and ab initio Calculations. Cheminform. 22: no-no. DOI: 10.1002/chin.199126069 |
0.422 |
|
| 2010 |
DURIG JR, SULLIVAN JF, QTAITAT MA. ChemInform Abstract: IR and Raman Spectra, Conformational Stability, Barriers to Internal Rotation, ab initio Calculations, r0 Structure, and Vibrational Assignment for Methyl Vinyl Silane Cheminform. 22: no-no. DOI: 10.1002/chin.199122178 |
0.569 |
|
| 2010 |
DURIG JR, SHEEHAN TG, HARDIN JA. ChemInform Abstract: Conformational Stability, Barriers to Internal Rotation, and Vibrational Assignment of 1-Bromo-3,3,3-trifluoro-2-propanone Cheminform. 22: no-no. DOI: 10.1002/chin.199122038 |
0.457 |
|
| 2010 |
DURIG JR, SULLIVAN JF, GUIRGIS GA, QTAITAT MA. ChemInform Abstract: IR and Raman Spectra, Conformational Stability, Barriers to Internal Rotation, Normal-Coordinate Calculations, and Vibrational Assignment for Vinylsilyl Chloride. Cheminform. 22: no-no. DOI: 10.1002/CHIN.199121205 |
0.568 |
|
| 2010 |
DURIG JR, SHEEHAN TG. ChemInform Abstract: IR Spectra, Vibrational Assignment and ab initio Calculations for 2,2, 2-Trifluoroethanimidamide Cheminform. 22: no-no. DOI: 10.1002/chin.199106036 |
0.545 |
|
| 2010 |
STAMPF EJ, ODOM JD, SAARI SV, KIM YH, BERGANA MM, DURIG JR. ChemInform Abstract: Dimethylmethoxyborane: Vibrational Assignment, Conformational Stability, ab initio Calculations and Barriers to Internal Rotation. Cheminform. 22: no-no. DOI: 10.1002/chin.199105042 |
0.545 |
|
| 2010 |
BELL S, GUIRGIS GA, LIN J, DURIG JR. ChemInform Abstract: Far IR Spectrum, Barrier to Internal Rotation, r0 Structure, and ab initio Calculations for Acetyl Cyanide. Cheminform. 22: no-no. DOI: 10.1002/CHIN.199102059 |
0.461 |
|
| 2010 |
ODOM JD, BOCCANFUSO AM, BERGANA MM, LITTLE TS, DURIG JR. ChemInform Abstract: IR and Raman Spectra, Conformational Stability, Vibrational Assignment and Normal Coordinate Analysis of Methyltrifluoromethyldiselenide and Bis(trifluoromethyl)diselenide. Cheminform. 22: no-no. DOI: 10.1002/chin.199102058 |
0.498 |
|
| 2010 |
GUIRGIS GA, NANAIE H, DURIG JR. ChemInform Abstract: Microwave and FIR Spectra, r0 Structure, Barriers to Internal Rotation, and ab initio Calculations for 2-Fluoropropane. Cheminform. 22: no-no. DOI: 10.1002/chin.199101049 |
0.478 |
|
| 2009 |
Durig JR, El Defrawy AM, Ganguly A, Gounev TK, Guirgis GA. Conformational stability, r0 structural parameters, ab initio calculations, and vibrational assignment for fluorocyclopentane. The Journal of Physical Chemistry. A. 113: 9675-83. PMID 19673493 DOI: 10.1021/Jp902521E |
0.804 |
|
| 2009 |
Foellmer MD, Murray JM, Serafin MM, Steber AL, Peebles RA, Peebles SA, Eichenberger JL, Guirgis GA, Wurrey CJ, Durig JR. Microwave spectra and barrier to internal rotation in cyclopropylmethylsilane. The Journal of Physical Chemistry. A. 113: 6077-82. PMID 19456177 DOI: 10.1021/Jp902033G |
0.364 |
|
| 2009 |
Nashed YE, Qtaitat MA, Zheng C, Zhou X, Guirgis GA, Sullivan JF, Durig JR. Conformational stability from rare gas solutions, r0 structural parameters, barriers to internal rotation, and ab initio calculations for vinyl silyl fluoride. The Journal of Physical Chemistry. A. 113: 1653-62. PMID 19199671 DOI: 10.1021/Jp8076547 |
0.882 |
|
| 2009 |
Durig JR, Klaassen JJ, Ganguly A, Gounev T, Groner P. The r0 structural parameters, conformational stability, and vibrational assignment of equatorial and axial bromocyclobutane Journal of Molecular Structure. 934: 66-78. DOI: 10.1016/J.Molstruc.2009.06.017 |
0.9 |
|
| 2009 |
Durig JR, Zhou SX, Garner AX, Durig NE. Structural parameters, centrifugal distortion constants, and vibrational spectra of F2C{double bond, long}NX (X = H, F, Cl, Br) molecules Journal of Molecular Structure. 922: 11-18. DOI: 10.1016/J.Molstruc.2009.01.052 |
0.535 |
|
| 2009 |
Durig JR, Ward RM, Conrad AR, Tubergen MJ, Giurgis GA, Gounev TK. Microwave spectra, r0 structural parameters, and conformational stability from xenon solutions of silylcyclohexane Journal of Molecular Structure. 922: 19-29. DOI: 10.1016/J.Molstruc.2009.01.046 |
0.674 |
|
| 2009 |
Lin W, Ganguly A, Minei AJ, Lindeke GL, Pringle WC, Novick SE, Durig JR. Microwave spectra and structural parameters of equatorial-trans cyclobutanol Journal of Molecular Structure. 922: 83-87. DOI: 10.1016/J.Molstruc.2009.01.040 |
0.804 |
|
| 2009 |
Guirgis GA, Panikar SS, El Defrawy AM, Kalasinsky VF, Durig JR. Vibrational spectra, r0 structural parameters, barriers to internal rotation, and ab initio calculations of ClCH2SiH3, Cl2CHSiH3, ClCH2SiF3 and Cl2CHSiF3 Journal of Molecular Structure. 922: 93-102. DOI: 10.1016/J.Molstruc.2009.01.025 |
0.848 |
|
| 2009 |
Durig JR, Panikar SS, Guirgis GA, Gounev TK, Ward RM, Peebles RA, Peebles SA, Liberatore RJ, Bell S, Wurrey CJ. Conformational stability, r0 structural parameters, barriers to internal rotation, vibrational spectra and ab initio calculations of c-C3H5SiH2CH3 Journal of Molecular Structure. 923: 1-12. DOI: 10.1016/J.Molstruc.2008.12.017 |
0.894 |
|
| 2009 |
Zhou SX, Durig JR. The r0 structural parameters, vibrational spectra, ab initio calculations and barriers to internal rotation and linearity of methylisocyanate Journal of Molecular Structure. 924: 111-119. DOI: 10.1016/J.Molstruc.2008.12.011 |
0.622 |
|
| 2009 |
Durig JR, Ganguly A, El Defrawy AM, Guirgis GA, Gounev TK, Herrebout W, van der Veken B. Conformational stability, r0 structural parameters, barriers to internal rotation and vibrational assignment of cyclobutylamine Journal of Molecular Structure. 918: 64-76. DOI: 10.1016/J.Molstruc.2008.07.013 |
0.775 |
|
| 2009 |
Durig JR, El Defrawy AM, Ward RM, Guirgis GA, Gounev TK. Conformational stability of bromocyclohexane from temperature dependent FT-IR spectra of xenon solutions, r0 structural parameters and vibrational assignment Journal of Molecular Structure. 918: 26-38. DOI: 10.1016/J.Molstruc.2008.07.009 |
0.688 |
|
| 2009 |
Durig JR, Zhou X, Durig NE, Nguyen D, Durig DT. Vibrational spectra and structural parameters of some XNCO and XOCN (X = H, F, Cl, Br) molecules Journal of Molecular Structure. 917: 37-51. DOI: 10.1016/J.Molstruc.2008.05.059 |
0.559 |
|
| 2009 |
Durig JR, Ganguly A, Guirgis GA, Bell S, Mohamed TA, Gounev TK. Conformational stability, r 0 structural parameters, barriers to internal rotation, ab initio calculations, and vibrational assignment for 2,2-difluoroethanol Structural Chemistry. 20: 489-503. DOI: 10.1007/S11224-009-9446-8 |
0.812 |
|
| 2009 |
Durig JR, Ward RM, Guirgis GA, Gounev TK. Conformational stability from Raman spectra, r0 structural parameters, and vibrational assignment of methylcyclohexane Journal of Raman Spectroscopy. 40: 1919-1930. DOI: 10.1002/Jrs.2341 |
0.757 |
|
| 2008 |
Durig JR, Ganguly A, El Defrawy AM, Gounev TK, Guirgis GA. Conformational stability of cyclobutanol from temperature dependent infrared spectra of xenon solutions, r0 structural parameters, ab initio calculations and vibrational assignment. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 71: 1379-89. PMID 18602334 DOI: 10.1016/J.Saa.2008.04.010 |
0.786 |
|
| 2008 |
Guirgis GA, Yu Z, Zheng C, Zhou SX, Durig JR. Conformational stability from variable temperature FT-IR spectra of krypton solutions, r0 structural parameters, vibrational assignment, and ab initio calculations of 4-fluoro-1-butene. The Journal of Physical Chemistry. A. 112: 2268-81. PMID 18298100 DOI: 10.1021/Jp0748213 |
0.725 |
|
| 2008 |
Galabov B, Kim S, Xie Y, Schaefer HF, Leininger ML, Durig JR. Conformations of allyl amine: theory vs experiment. The Journal of Physical Chemistry. A. 112: 2120-4. PMID 18247513 DOI: 10.1021/Jp710585Q |
0.555 |
|
| 2008 |
Durig JR, Panikar S, Zhou X, El Defrawy AM. Vibrational spectrum, conformational stability, structural parameters and ab initio calculations of dimethylaminodifluorophosphine. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 69: 715-25. PMID 17604210 DOI: 10.1016/J.Saa.2007.05.024 |
0.838 |
|
| 2008 |
Durig JR, Tschudin P, Cohn KC, Durig BR, Zhou X, Zheng C, El Defrawy AM. Infrared and Raman spectra, conformational stability, structural parameters, ab initio calculations and vibrational assignments of aminodifluorophosphine Journal of Molecular Structure. 875: 406-418. DOI: 10.1016/J.Molstruc.2007.04.045 |
0.749 |
|
| 2008 |
Durig JR, Klaassen JJ, Ganguly A, Gounev TK, Guirgis GA, Lin W. The r0 structural parameters of equatorial and axial chlorocyclobutane, conformational stability from temperature dependent infrared spectra of xenon solutions, and vibrational assignments Structural Chemistry. 19: 935-948. DOI: 10.1007/S11224-008-9378-8 |
0.899 |
|
| 2008 |
Durig JR, El Defrawy AM, Ward RM, Guirgis GA, Gounev TK. Conformational stability of chlorocyclohexane from temperature-dependent FT-IR spectra of xenon solutions, r 0 structural parameters, and vibrational assignment Structural Chemistry. 19: 579-594. DOI: 10.1007/S11224-008-9328-5 |
0.688 |
|
| 2008 |
Durig JR, Zheng C, El Defrawy AM, Ward RM, Gounev TK, Ravindranath K, Rajeswara Rao N. On the relative intensities of the Raman active fundamentals, r
0
structural parameters, and pathway of chair-boat interconversion of cyclohexane and cyclohexane-d
12 Journal of Raman Spectroscopy. 40: 197-204. DOI: 10.1002/Jrs.2107 |
0.659 |
|
| 2007 |
Durig JR, Zheng C. Conformational stability, structural parameters and vibrational assignment from variable temperature infrared spectra of krypton solutions and ab initio calculations of ethylisothiocyanate. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 68: 783-95. PMID 17433767 DOI: 10.1016/J.Saa.2007.01.001 |
0.78 |
|
| 2007 |
Guirgis GA, Defrawy AME, Gounev TK, Soliman MS, Durig JR. Conformational stability, r0 structural parameters, ab initio calculations, and vibrational assignment for germacyclopentane Journal of Molecular Structure. 832: 17-29. DOI: 10.1016/J.Molstruc.2006.11.050 |
0.676 |
|
| 2007 |
Durig JR, Zhou X, El Defrawy AM, Guirgis GA, Gounev TK, Zheng C. Conformational stability, structural parameters, vibrational spectra, and ab initio calculations of isopropyl- and tertiary-butylisothiocyanate Journal of Molecular Structure. 839: 107-124. DOI: 10.1016/J.Molstruc.2006.10.051 |
0.775 |
|
| 2007 |
Zheng C, Guirgis GA, Deeb H, Durig JR. On the structural parameters and vibrational spectra of CH3NCS, SiH3NCS and GeH3NCS Journal of Molecular Structure. 829: 88-110. DOI: 10.1016/J.Molstruc.2006.06.011 |
0.638 |
|
| 2006 |
Zheng C, Guirgis GA, Herrebout WA, van der Veken BJ, Wurrey CJ, Durig JR. Conformational studies of cyclopropylmethyl isothiocyanate from temperature-dependent FT-IR spectra of rare gas solutions and ab initio calculations. The Journal of Physical Chemistry. A. 110: 9057-70. PMID 16854016 DOI: 10.1021/Jp0603740 |
0.72 |
|
| 2006 |
Durig JR, Zheng C, Xiao J, Zhao W, Sanders RS, van der Veken BJ. Microwave spectra, ab initio calculations, and r0 structural parameters for (methylamino)thiophosphoryl difluoride. The Journal of Physical Chemistry. A. 110: 8037-43. PMID 16805489 DOI: 10.1021/Jp061882C |
0.715 |
|
| 2006 |
Durig JR, Zheng C, Gounev TK, Herrebout WA, van der Veken BJ. Conformational stability from temperature-dependent fourier transform infrared spectra of noble gas solutions, r0 structural parameters, and barriers to internal rotation for ethylamine. The Journal of Physical Chemistry. A. 110: 5674-84. PMID 16640362 DOI: 10.1021/Jp057305Q |
0.772 |
|
| 2006 |
Durig JR, Zheng C, Guirgis GA, Wurrey CJ. Conformational studies of cyclopropylmethyl isocyanate from temperature dependent FT-IR spectra of xenon solutions and ab initio calculations Journal of Molecular Structure. 800: 120-134. DOI: 10.1016/J.Molstruc.2006.04.004 |
0.786 |
|
| 2006 |
Durig JR, Zheng C, Guirgis GA, Zhen H, Drew AS, Durig DT. Raman and infrared spectra, conformational stability, barriers to internal rotation, vibrational assignment, and ab initio calculations of 3-methyl-3-butenenitrile Journal of Molecular Structure. 786: 9-24. DOI: 10.1016/J.Molstruc.2005.10.015 |
0.774 |
|
| 2006 |
Zheng C, Subramaniam S, Kalasinsky VF, Durig JR. Raman and infrared studies supported by ab initio calculations for the determination of conformational stability, silyl rotational barrier and structural parameters of cyclohexyl silane Journal of Molecular Structure. 785: 143-159. DOI: 10.1016/J.Molstruc.2005.09.039 |
0.798 |
|
| 2006 |
Durig JR, Zheng C, Deeb H. On the structural parameters and vibrational spectra of some XNCS and XSCN (X=H, F, Cl, Br) molecules Journal of Molecular Structure. 784: 78-92. DOI: 10.1016/J.Molstruc.2005.06.034 |
0.672 |
|
| 2006 |
Zheng C, Yazdi MR, Kalasinsky VF, Durig JR. Vibrational spectra, conformational stability, structural parameters andab initio calculations of 2,2,5,5-tetramethyl-2,5-disila-1-oxacyclopentane Journal of Raman Spectroscopy. 37: 52-67. DOI: 10.1002/Jrs.1465 |
0.761 |
|
| 2005 |
Durig JR, Zheng C, Guirgis GA, Wurrey CJ. Conformational stabilities of 1,1-dicyclopropylethene determined from variable-temperature infrared spectra of xenon solutions and ab initio calculations. The Journal of Physical Chemistry. A. 109: 1650-61. PMID 16833490 DOI: 10.1021/Jp040609C |
0.691 |
|
| 2005 |
Durig JR, Zheng C, Marzluf KR, Marquez GB, Guirgis GA, Wurrey CJ, Kilway KV. Is 2-cyclopropylpropene really gauche? Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 61: 1357-73. PMID 15820869 DOI: 10.1016/J.Saa.2004.10.004 |
0.765 |
|
| 2005 |
Durig DT, Durig MS, Durig JR. On the vibrational spectra and structural parameters of methyl, silyl, and germyl azide from theoretical predictions and experimental data. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 61: 1287-306. PMID 15820863 DOI: 10.1016/J.Saa.2004.12.035 |
0.59 |
|
| 2005 |
Pan C, Guirgis GA, Durig JR. Infrared and Raman spectra, conformational analysis, ab initio calculations and vibrational assignment of 2-chloroethylsilyl chloride Journal of Molecular Structure. 742: 199-213. DOI: 10.1016/J.Molstruc.2004.12.058 |
0.847 |
|
| 2005 |
Durig JR, Zheng C, Guirgis GA, Nanaie H. Microwave spectrum, r0 structure, barriers to internal rotation and ab initio calculations of gauche-1,1-difluoropropane Journal of Molecular Structure. 742: 191-198. DOI: 10.1016/J.Molstruc.2004.12.057 |
0.604 |
|
| 2005 |
Durig JR, Zheng C, Deeb H, Guirgis GA. Conformational stability from variable temperature infrared spectra of krypton and xenon solutions, ab initio calculations, vibrational assignment and r0 structural parameters of vinylcyclopropane Journal of Molecular Structure. 744: 3-17. DOI: 10.1016/J.Molstruc.2004.11.071 |
0.795 |
|
| 2005 |
Guirgis GA, Bell S, Zheng C, Groner P, Durig JR. Raman, infrared and far infrared spectra, ab initio calculations, r 0 structural parameters, and internal rotation of 3-methyl-1-butyne Journal of Molecular Structure. 733: 167-179. DOI: 10.1016/J.Molstruc.2004.07.040 |
0.738 |
|
| 2004 |
Durig JR, Zheng C, Williams MJ, Stidham HD, Guirgis GA. Conformational stability from variable temperature infrared spectra of krypton solutions, ab initio calculations, vibrational assignment, and r0 structural parameters of 1,3-difluoropropane. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 60: 1659-76. PMID 15147712 DOI: 10.1016/J.Saa.2003.08.024 |
0.86 |
|
| 2004 |
Durig DT, Shen S, Li Y, Durig JR. Conformational stabilities and structural parameters of (CH3)(n)CH(3-n) CFO molecules. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 60: 1481-504. PMID 15147690 DOI: 10.1016/J.Saa.2003.07.009 |
0.664 |
|
| 2004 |
Durig JR, Zhu X, Guirgis GA. Infrared and Raman spectra, conformational stability, ab initio calculations and vibrational assignment of 2-fluorobutane. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 60: 829-41. PMID 15036094 DOI: 10.1016/S1386-1425(03)00308-1 |
0.682 |
|
| 2004 |
Duffy DJ, Quenneville J, Baumbaugh TM, Kitchener SA, McCormick RK, Dormady CN, Croce TA, Navabi A, Stidham HD, Hsu SL, Guirgis GA, Deng S, Durig JR. Vibrational spectrum, ab initio calculations, conformational equilibria and torsional modes of 1,3-dichloropropane. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 60: 659-71. PMID 14747092 DOI: 10.1016/S1386-1425(03)00276-2 |
0.823 |
|
| 2004 |
Durig JR, Pan C, Witkowski W, Guirgis GA. Conformational stability, infrared and Raman spectra, and vibrational assignment of ethyl bromogermane Canadian Journal of Chemistry. 82: 964-977. DOI: 10.1139/V04-048 |
0.838 |
|
| 2004 |
Guirgis GA, Bell S, Groner P, Zheng C, Durig JR. Infrared, Raman and far infrared spectra, ab initio calculations, and internal rotation of 3-fluoro-3-methyl-1-butyne Physical Chemistry Chemical Physics. 6: 3919-3927. DOI: 10.1039/B404641B |
0.753 |
|
| 2004 |
Durig JR, Ng KW, Zheng C, Shen S. Comparison of Ab Initio MP2/6-311+G(d,p) Predicted Carbon–Hydrogen Bond Distances with Experimentally Determined r 0 (C–H) Distances Structural Chemistry. 15: 149-157. DOI: 10.1023/B:Stuc.0000011249.33964.2C |
0.608 |
|
| 2004 |
Durig JR, Yu Z, Zheng C, Guirgis GA. Conformational Studies of Fluoromethylcyclopropane from Temperature-Dependent FT-IR Spectra of Xenon Solutions and Ab Initio Calculations The Journal of Physical Chemistry A. 108: 5353-5364. DOI: 10.1021/Jp0401168 |
0.659 |
|
| 2004 |
Guirgis GA, Bell S, Deeb H, Zheng C, Durig JR. Infrared and Raman spectra, ab initio calculations, barriers to internal rotation, and vibrational assignment of 4-fluoro-2-pentyne Journal of Molecular Structure. 706: 141-152. DOI: 10.1016/J.Molstruc.2004.03.060 |
0.757 |
|
| 2004 |
Durig JR, Zheng C. On the vibrational spectra and conformational stability of 1,1-dimethylhydrazine from temperature dependent FT-IR spectra of krypton solutions and ab initio calculations Journal of Molecular Structure. 690: 31-44. DOI: 10.1016/J.Molstruc.2003.11.024 |
0.78 |
|
| 2004 |
Durig JR, Pan C, Guirgis GA. Spectra and structure of silicon containing compounds. XLII. Conformational stability, ab initio calculations, r0 structural parameters, and vibrational assignments for ethylmethylsilane and ethylmethylsilane-Si-d2 Journal of Molecular Structure. 688: 95-109. DOI: 10.1016/J.Molstruc.2003.09.025 |
0.847 |
|
| 2004 |
Zhu X, Herrebout W, van der Veken B, Shen S, Durig J. Conformational stability from temperature-dependent FT-IR spectra of krypton solutions, vibrational spectra and assignment, ab initio calculations, and r0 structural parameters of 2-chlorobutane Journal of Molecular Structure. 688: 41-58. DOI: 10.1016/J.Molstruc.2003.08.018 |
0.714 |
|
| 2004 |
Aleksa V, Klaeboe P, Nielsen CJ, Guirgis GA, Durig JR. Vibrational spectroscopic studies, conformations andab initio calculations ofn-propyltrichlorosilane Journal of Raman Spectroscopy. 35: 975-990. DOI: 10.1002/Jrs.1245 |
0.588 |
|
| 2003 |
Durig JR, Hur SW, Guirgis GA. Infrared and Raman spectra, conformational stability, vibrational assignment and ab initio calculations of methylvinyl silyl chloride. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 59: 2449-71. PMID 12963442 DOI: 10.1016/S1386-1425(02)00379-7 |
0.878 |
|
| 2003 |
Durig JR, Pan C, Klaeboe P, Aleksa V, Guirgis GA. Spectra and structure of silicon containing compounds. XXXIX. Raman and infrared spectra, conformational stability, vibrational assignment and ab initio calculations of n-propyltrifluorosilane. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 59: 2151-73. PMID 12788468 DOI: 10.1016/S1386-1425(03)00033-7 |
0.841 |
|
| 2003 |
Durig JR, Guirgis GA, Zheng C, Mohamed TA. Spectra and structure of silicon-containing compounds. Part XXXVIII: Infrared and Raman spectra, vibrational assignment, conformational stability, and ab initio calculations of vinyldifluorosilane. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 59: 2099-114. PMID 12788463 DOI: 10.1016/S1386-1425(03)00016-7 |
0.775 |
|
| 2003 |
Durig DT, Yu Z, Pan C, Durig JR. Conformational stability from variable temperature infrared spectra of rare gas solutions of 2-chloro-3-fluoropropene. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 59: 1579-92. PMID 12714081 DOI: 10.1016/S1386-1425(02)00354-2 |
0.789 |
|
| 2003 |
Durig JR, Pan C, Guirgis GA. Spectra and structure of silicon containing compounds. XXXII. Raman and infrared spectra, conformational stability, vibrational assignment and ab initio calculations of n-propylsilane-d0 and Si-d3. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 59: 979-1002. PMID 12633715 DOI: 10.1016/S1386-1425(02)00263-9 |
0.813 |
|
| 2003 |
Durig JR, Zhu X, Guirgis GA, Heldrich FJ, Wright MJ. Infrared and Raman spectra, conformational stability, Ab initio calculations, and vibrational assignment of 1-penten-4-yne Journal of Physical Chemistry A. 107: 8139-8148. DOI: 10.1039/B301450A |
0.721 |
|
| 2003 |
Guirgis GA, Zhu X, Heldrich FJ, Wright MJ, Durig JR. Infrared and Raman spectra, conformational stability, ab initio calculations and vibrational assignment of 1-hexen-4-yne Physical Chemistry Chemical Physics. 5: 2541-2551. DOI: 10.1039/b301450a |
0.582 |
|
| 2003 |
Badawi HM, Herrebout WA, Zheng C, Mohamed TA, Veken BJvd, Durig JR. Conformational Stability from Variable-Temperature Infrared Spectra of Krypton Solutions, Ab Initio Calculations, and r o Structural Parameters of Chlorocyclopentane Structural Chemistry. 14: 617-635. DOI: 10.1023/B:Stuc.0000007573.21013.E6 |
0.777 |
|
| 2003 |
Durig JR, Shen S. Conformational Stability of Propenoyl Bromide from Temperature-Dependent Infrared Spectra of Krypton Solutions, Ab Initio Calculations, and r 0 Structural Parameters of the Propenoyl Halides (F, Cl, Br) Structural Chemistry. 14: 199-210. DOI: 10.1023/A:1022146701017 |
0.707 |
|
| 2003 |
Durig JR, Zheng C, Warren RD, Groner P, Wurrey CJ, Gounev TK, Herrebout WA, Van der Veken BJ. Conformational and structural studies of aminomethyl cyclopropane from temperature dependent FT-IR spectra of rare gas solutions and ab initio calculations Journal of Physical Chemistry A. 107: 7713-7726. DOI: 10.1021/Jp030552E |
0.771 |
|
| 2003 |
Klaeboe P, Richard CJ, Aleksa V, Nielsen CJ, Guirgis GA, Durig JR. Conformational equilibrium in dimethylvinylsilane and dimethylvinylsilane-d1 studied by infrared and Raman spectroscopy and by ab initio calculations Journal of Molecular Structure. 661: 81-107. DOI: 10.1016/S0022-2860(03)00519-2 |
0.669 |
|
| 2003 |
Shen S, Durig JR. On the vibrational spectra and structural parameters of some XN 3 molecules (X = H, F, Cl, Br) Journal of Molecular Structure. 661: 49-64. DOI: 10.1016/S0022-2860(03)00515-5 |
0.569 |
|
| 2003 |
Durig JR, Zheng C, Qtaitat MA, Deng S, Guirgis GA. Conformational stability from variable temperature infrared spectra of krypton solutions of 1,3-dichloropropane Journal of Molecular Structure. 657: 357-373. DOI: 10.1016/S0022-2860(03)00454-X |
0.753 |
|
| 2003 |
Guirgis GA, Pan C, Bregg J, Durig JR. Spectra and structure of silicon containing compounds. XLI. Infrared and Raman spectra, conformational stability, vibrational assignment and ab initio calculations of cyclopropylbromosilane Journal of Molecular Structure. 657: 239-254. DOI: 10.1016/S0022-2860(03)00411-3 |
0.86 |
|
| 2003 |
Durig JR, Pan C, Guirgis GA. Spectra and structure of silicon containing compounds. XL. Infrared and Raman spectra, conformational stability, vibrational assignment and ab initio calculations of ethylmethylsilyl difluoride Journal of Molecular Structure. 656: 287-302. DOI: 10.1016/S0022-2860(03)00341-7 |
0.846 |
|
| 2003 |
Guirgis GA, Zheng C, Gounev TK, Durig JR. Conformational stability, ab initio calculations, and r0 structural parameters of 3-methyl-1-butene and dimethylvinylsilane Journal of Molecular Structure. 651: 771-780. DOI: 10.1016/S0022-2860(03)00123-6 |
0.744 |
|
| 2003 |
Guirgis GA, Zheng C, Shen S, Durig JR. Spectra and structure of silicon containing compounds XXXVII, comparison of experimentally determined enthalpy differences of the conformers of CH2CHSiClnY3−n (Y=H or CH3, n=1 or 2) with theoretical values Journal of Molecular Structure. 651: 759-770. DOI: 10.1016/S0022-2860(03)00122-4 |
0.707 |
|
| 2003 |
Guirgis GA, Zheng C, Nashed YE, Mohamed TA, Durig JR. Spectra and structure of silicon containing compounds XXXV infrared and Raman spectra, vibrational assignment, conformational stability, and ab initio calculations of dichloromethyldimethyl silane Journal of Molecular Structure. 649: 7-24. DOI: 10.1016/S0022-2860(02)00583-5 |
0.896 |
|
| 2003 |
Herrebout W, Zheng C, van der Veken B, Durig J. Conformational stability of allyl amine from temperature dependent infrared spectra of rare gas solutions, ab initio calculations, r0 structural parameters, and vibrational assignment Journal of Molecular Structure. 645: 109-132. DOI: 10.1016/S0022-2860(02)00540-9 |
0.783 |
|
| 2003 |
Badawi H, Herrebout W, Mohamed T, van der Veken B, Sullivan J, Durig D, Zheng C, Kalasinsky K, Durig J. Conformational stability from variable temperature infrared spectra of krypton solutions, ab initio calculations, and vibrational assignment of bromocyclopentane Journal of Molecular Structure. 645: 89-107. DOI: 10.1016/S0022-2860(02)00539-2 |
0.803 |
|
| 2003 |
Guirgis GA, Klaboe P, Shen S, Powell DL, Gruodis A, Aleksa V, Nielsen CJ, Tao J, Zheng C, Durig JR. Spectra and structure of silicon-containing compounds. XXXVI?Raman and infrared spectra, conformational stability,ab initio calculations and vibrational assignment of ethyldibromosilane Journal of Raman Spectroscopy. 34: 322-336. DOI: 10.1002/Jrs.989 |
0.75 |
|
| 2003 |
Gruodis A, Aleksa V, Powell DL, Klaeboe P, Nielsen CJ, Guirgis GA, Durig JR. Vibrational spectroscopic studies, conformations andab initio calculations of 1,1,1-trifluoropropyltrifluorosilane Journal of Raman Spectroscopy. 34: 711-724. DOI: 10.1002/Jrs.1036 |
0.6 |
|
| 2002 |
Guirgis GA, Pan C, Durig JR. Spectra and structure of silicon-containing compounds. XXX. Raman and infrared spectra, conformational stability, vibrational assignment of chloromethyl silyl dichloride. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 58: 1839-52. PMID 12164484 DOI: 10.1016/S1386-1425(01)00643-6 |
0.843 |
|
| 2002 |
Durig JR, Zhen P, Guirgis GA, Gounev TK. Infrared and Raman spectra, conformational stability, ab initio calculations of structure, and vibrational assignment of ethynylmethyl cyclobutane. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 58: 91-111. PMID 11808654 DOI: 10.1016/S1386-1425(01)00520-0 |
0.725 |
|
| 2002 |
Guirgis GA, Bell S, Zheng C, Durig JR. Infrared and Raman spectra, conformational stability, vibrational assignment, ab initio calculations and r0 structural parameters for N-methylpropargyl amineElectronic supplementary information (ESI) available: IR and Raman assignments (Table 1S), symmetry coordinates (Table 2S), and internal coordinates of N-methylpropargyl amine (Fig. 1S). See http://www.rsc.org/suppdata/cp/b1/b109222g/ Physical Chemistry Chemical Physics. 4: 1438-1450. DOI: 10.1039/B109222G |
0.753 |
|
| 2002 |
Durig JR, Jin Y, Phan HV, Liu J, Durig DT. Far-infrared spectra, conformational stability, barriers to internal rotation, ab initio calculations, r0 structural parameters, and vibrational assignment of ethyl methyl ether Structural Chemistry. 13: 1-26. DOI: 10.1023/A:1013410428690 |
0.631 |
|
| 2002 |
Durig JR, Gounev TK, Zheng C, Choulakian A, Verma VN. Conformational Stability from Temperature-Dependent FT-IR Spectra of Liquid Xenon Solutions, ab Initio Calculations, andr0Parameters for Methylhydrazine†,‡ The Journal of Physical Chemistry A. 106: 3395-3402. DOI: 10.1021/Jp012244R |
0.759 |
|
| 2002 |
Galabov B, Kenny JP, Schaefer HF, Durig JR. Conformational Stability of 3-Fluoropropene: A Challenging Problem for Both Theory and Experiment The Journal of Physical Chemistry A. 106: 3625-3628. DOI: 10.1021/Jp011851B |
0.557 |
|
| 2002 |
Durig JR, Zheng C. On the vibrational spectra and structural parameters of hydrazine and some methyl substituted hydrazines Vibrational Spectroscopy. 30: 59-67. DOI: 10.1016/S0924-2031(02)00039-5 |
0.685 |
|
| 2002 |
Mohamed TA, Guirgis GA, Nashed YE, Durig JR. Spectra and structure of silicon containing compounds: Part XXXIV. Raman and infrared spectra, vibrational assignment, barriers to internal rotation, and ab initio calculations of 1-chloroethylsilane Vibrational Spectroscopy. 30: 111-120. DOI: 10.1016/S0924-2031(02)00003-6 |
0.858 |
|
| 2002 |
Durig JR, Zheng C, Herrebout WA, van der Veken B. Conformational analysis, barriers to internal rotation and inversion, vibrational assignment, ab initio calculations, and r0 structural parameters of ethylmethylamine Journal of Molecular Structure. 641: 207-224. DOI: 10.1016/S0022-2860(02)00340-X |
0.772 |
|
| 2002 |
Bell S, Zhu X, Guirgis GA, Durig JR. Infrared and Raman spectra, conformational stability, ab initio calculations of structure, and vibrational assignment of 2-hexyne Journal of Molecular Structure. 616: 135-158. DOI: 10.1016/S0022-2860(02)00326-5 |
0.695 |
|
| 2002 |
Guirgis GA, Nashed YE, Tao J, Powell DL, Gruodis A, Aleksa V, Nielsen CJ, Klaeboe P, Durig JR. Spectra and structure of silicon containing compounds. XXXI. Raman and infrared spectra, conformational stability, ab initio calculations, and vibrational assignment of ethyl bromosilane and ethyl bromosilane-Si-d2 Journal of Molecular Structure. 641: 125-146. DOI: 10.1016/S0022-2860(02)00170-9 |
0.871 |
|
| 2002 |
Guirgis GA, Drew BR, Luangjamekorn NJ, Shen S, Durig JR. Infrared and Raman spectra, conformational stability, ab initio calculations, and vibrational assignment of 5-chloropent-2-yne Journal of Molecular Structure. 613: 15-35. DOI: 10.1016/S0022-2860(02)00125-4 |
0.899 |
|
| 2002 |
Durig JR, Pan C, Guirgis GA. Conformational stability of ethyl chlorogermane from temperature-dependent FT-IR spectra of krypton solutions and r0 structural parameters of methyl chlorogermane and ethyl germane Journal of Molecular Structure. 607: 117-132. DOI: 10.1016/S0022-2860(01)00917-6 |
0.843 |
|
| 2002 |
Guirgis GA, Pan C, Durig JR. Spectra and structure of silicon-containing compounds. XXXIII ? Raman and infrared spectra, conformational stability and vibrational assignment of chloromethylsilyl bromide Journal of Raman Spectroscopy. 33: 677-688. DOI: 10.1002/Jrs.891 |
0.858 |
|
| 2001 |
Stidham HD, Duffy DJ, Hsu SL, Guirgis GA, Durig JR. Raman and infrared spectra, conformational stability, ab initio calculations and assignment of fundamentals for 1-bromo-3-fluoropropane. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 57: 1567-86. PMID 11471709 DOI: 10.1016/S1386-1425(00)00491-1 |
0.808 |
|
| 2001 |
Guirgis GA, Bell S, Durig JR. Infrared and Raman spectra, ab initio calculations of structure and vibrational assignment of 1-fluoro-2-butyne. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 57: 1235-47. PMID 11419466 DOI: 10.1016/S1386-1425(00)00466-2 |
0.66 |
|
| 2001 |
Durig JR, Drew BR, Koomer A, Bell S. Infrared and Raman spectra, conformational stability, ab initio calculations of structure and vibrational assignment of butyronitrile Physical Chemistry Chemical Physics. 3: 766-775. DOI: 10.1039/B007856P |
0.896 |
|
| 2001 |
Bell S, Zhu X, Guirgis GA, Durig JR. Infrared and Raman spectra, conformational stability, ab initio calculations of structure and vibrational assignment of 5-fluoropent-2-yne Physical Chemistry Chemical Physics. 3: 776-785. DOI: 10.1039/B007765H |
0.583 |
|
| 2001 |
Durig JR, Zheng C. Infrared spectra of krypton solutions of methylamine Structural Chemistry. 12: 137-148. DOI: 10.1023/A:1016696526207 |
0.774 |
|
| 2001 |
Durig JR, Guirgis GA, Sullivan JF, Dickson TJ, Durig DT. Structural Chemistry. 12: 149-170. DOI: 10.1023/A:1016648610277 |
0.666 |
|
| 2001 |
Guirgis GA, Pan C, Shen S, Durig JR. Structural Chemistry. 12: 445-458. DOI: 10.1023/A:1012224707583 |
0.833 |
|
| 2001 |
Shen S, Guirgis GA, Durig JR. Structural Chemistry. 12: 33-43. DOI: 10.1023/A:1009258017813 |
0.643 |
|
| 2001 |
Durig JR, Hur SW, Gounev TK, Feng F, Guirgis GA. Conformational Analysis, Barriers to Internal Rotation, Vibrational Assignment, and ab Initio Calculations of 3-Fluoro-1-butene The Journal of Physical Chemistry A. 105: 4216-4225. DOI: 10.1021/jp003763h |
0.806 |
|
| 2001 |
Guirgis GA, Zhu X, Bell S, Durig JR. Conformational Analysis, Barriers to Internal Rotation, ab Initio Calculations, and Vibrational Assignment of 4-Fluoro-1-butyne The Journal of Physical Chemistry A. 105: 363-373. DOI: 10.1021/jp0021796 |
0.546 |
|
| 2001 |
Nashed YE, Guirgis GA, Durig JR. Spectra and structure of silicon containing compounds: XXIX. Conformational studies of methyl vinyl difluorosilane from temperature dependent FT-IR spectra of xenon and krypton solutions Vibrational Spectroscopy. 25: 151-161. DOI: 10.1016/S0924-2031(01)00091-1 |
0.864 |
|
| 2001 |
Shen S, Guirgis GA, Gao J, Durig JR. Infrared and Raman spectra, conformational stability, vibration assignment, and ab initio calculations for 3-bromo-3,3-difluoropropene Journal of Molecular Structure. 598: 213-227. DOI: 10.1016/S0022-2860(01)00636-6 |
0.735 |
|
| 2001 |
Durig JR, Xiao J, Guirgis GA. Spectra and structure of organophosphorus molecules. LXII. Conformational stability of (methylthio)dichloro phosphine from temperature-dependent infrared spectra of krypton solutions, structural parameters and ab initio calculations Journal of Molecular Structure. 595: 175-188. DOI: 10.1016/S0022-2860(01)00549-X |
0.805 |
|
| 2001 |
Klaeboe P, Nielsen CJ, Aleksa V, Gruodis A, Guirgis GA, Nashed YE, Durig JR. Vibrational spectroscopic studies, conformations and ab initio calculations of 2-chloroethyl trifluorosilane Journal of Molecular Structure. 567: 167-185. DOI: 10.1016/S0022-2860(01)00545-2 |
0.825 |
|
| 2001 |
Mastryukov VS, Boggs JE, Durig JR. How different can the bond angles be in two conformers Journal of Molecular Structure. 567: 101-106. DOI: 10.1016/S0022-2860(01)00537-3 |
0.438 |
|
| 2001 |
Durig J, Zhu X, Shen S. Conformational and structural studies of 1-chloropropane and 1-bromopropane from temperature-dependant FT-IR spectra of rare gas solutions and ab initio calculations Journal of Molecular Structure. 570: 1-23. DOI: 10.1016/S0022-2860(01)00473-2 |
0.68 |
|
| 2001 |
Durig JR, Drew BR, Shoop JA, Wurrey CJ. Conformational stability determination of chloromethyl thiirane from variable temperature FT-IR studies of rare gas solutions, structural parameters, and ab initio calculations Journal of Molecular Structure. 569: 195-212. DOI: 10.1016/S0022-2860(01)00430-6 |
0.884 |
|
| 2001 |
Durig JR, Xiao J. Conformational stability of (chloromethyl) phosphonothioic difluoride from temperature-dependent infrared spectra of rare gas solutions and r0 structural parameters Journal of Molecular Structure. 562: 145-156. DOI: 10.1016/S0022-2860(00)00966-2 |
0.786 |
|
| 2001 |
Guirgis GA, Shen S, Drew BR, Durig JR. Conformational stability from variable temperature FT-IR spectra of xenon solutions and ab initio calculations of trans 3-pentenenitrile and 3-methyl-3-butene nitrile Journal of Molecular Structure. 563: 551-554. DOI: 10.1016/S0022-2860(00)00910-8 |
0.868 |
|
| 2001 |
Guirgis GA, Nashed YE, Badawi HM, Durig JR. Conformational stabilities of CH2=CHSi(CH3)nX3-n(X=F and Cl) from variable temperature FT-IR spectra of rare gas solutions Journal of Molecular Structure. 563: 257-260. DOI: 10.1016/S0022-2860(00)00881-4 |
0.842 |
|
| 2001 |
Durig JR, Yu Z, Shen S, Warren R, Verma VN, Guirgis GA. Conformational studies of monosubstituted three-membered rings by variable temperature FT-IR spectra of rare gas solutions Journal of Molecular Structure. 563: 141-145. DOI: 10.1016/S0022-2860(00)00875-9 |
0.584 |
|
| 2001 |
Powell DL, Klaeboe P, Nielsen CJ, Aleksa V, Gruodis A, Richard CJ, Guirgis GA, Durig JR. Vibrational spectra, conformational equilibria and ab initio calculations of chloromethylmethyl dichlorosilane Journal of Molecular Structure. 563: 523-528. DOI: 10.1016/S0022-2860(00)00836-X |
0.652 |
|
| 2001 |
Ilieva S, Galabov B, Dudev T, Gounev TK, Durig JR. Effective bond charges from infrared intensities in CH4, SiH4, GeH4 and SnH4 Journal of Molecular Structure. 565: 395-398. DOI: 10.1016/S0022-2860(00)00799-7 |
0.376 |
|
| 2001 |
Durig J, Shen S, Guirgis G. Far infrared spectra, conformational equilibria, vibrational assignments, ab initio calculations and structural parameters for 2-bromoethanol Journal of Molecular Structure. 560: 295-314. DOI: 10.1016/S0022-2860(00)00770-5 |
0.67 |
|
| 2001 |
Durig JR, Drew BR. Conformational stability of 1-pentyne from temperature dependent FT-IR spectra of liquid rare gas solutions and ab initio calculations Journal of Molecular Structure. 560: 247-259. DOI: 10.1016/S0022-2860(00)00760-2 |
0.878 |
|
| 2001 |
van der Veken B, Sanders R, Xiao J, Durig J. Infrared and Raman spectra, conformational stability, ab initio calculations, and vibrational assignments for methylaminothiophosphoryl difluoride Journal of Molecular Structure. 560: 57-86. DOI: 10.1016/S0022-2860(00)00759-6 |
0.772 |
|
| 2001 |
Durig JR, Nashed YE, Tao J, Guirgis GA. Conformational and structural studies of ethyl fluorosilane from temperature dependent FT-IR spectra of krypton solutions and ab initio calculations Journal of Molecular Structure. 560: 39-55. DOI: 10.1016/S0022-2860(00)00758-4 |
0.896 |
|
| 2001 |
Gounev TK, Nashed YE, Koomer A, Wurrey CJ, Durig JR. Conformational stabilities of dicyclopropyl methane determined from variable temperature infrared spectra of rare gas solutions and ab initio calculations Journal of Molecular Structure. 559: 273-293. DOI: 10.1016/S0022-2860(00)00711-0 |
0.886 |
|
| 2001 |
Durig JR, Drew BR, Guirgis GA. Raman and infrared spectra, conformational stability from temperature-dependent Fourier transform infrared spectra of xenon solutions, ab initio calculations and vibrational assignment of 4-chlorobut-1-yne Journal of Raman Spectroscopy. 32: 757-769. DOI: 10.1002/Jrs.740 |
0.897 |
|
| 2001 |
Durig JR. ChemInform Abstract: Structural Parameters and Conformational Stabilities of Some Monosubstituted Methylcyclopropanes and Oxiranes Cheminform. 32: no-no. DOI: 10.1002/chin.200102292 |
0.312 |
|
| 2000 |
Gounev TK, Guirgis GA, Zhen P, Durig JR. Spectra and structure of small ring compounds. LXVII. Vibrational spectra, variable temperature FT-IR spectra of krypton solutions, conformational stability and ab initio calculations of 1-bromosilacyclobutane Spectrochimica Acta - Part a: Molecular and Biomolecular Spectroscopy. 56: 2563-2579. PMID 11132139 DOI: 10.1016/S1386-1425(00)00365-6 |
0.748 |
|
| 2000 |
Durig JR, Shen S. Conformational studies of cyclopropane carboxaldehydehyde from temperature-dependent FT-IR spectra of xenon solutions Spectrochimica Acta - Part a: Molecular and Biomolecular Spectroscopy. 56: 2545-2561. PMID 11132138 DOI: 10.1016/S1386-1425(00)00364-4 |
0.729 |
|
| 2000 |
Durig JR, Drew BR, Reese CE, Brletic PA. Infrared and Raman spectra, conformational stability, ab initio calculations and vibrational assignments for trans-3-chloropropenoyl chloride. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 56: 2091-106. PMID 11058054 DOI: 10.1016/S1386-1425(00)00259-6 |
0.879 |
|
| 2000 |
Guirgis GA, Zhen P, Durig JR. Spectra and structure of silicon containing compounds. XXVII. Raman and infrared spectra, conformational stability, vibrational assignment and ab initio calculations of vinyldichlorosilane Spectrochimica Acta - Part a: Molecular and Biomolecular Spectroscopy. 56: 1957-1970. PMID 10989888 DOI: 10.1016/S1386-1425(00)00254-7 |
0.653 |
|
| 2000 |
Guirgis GA, Nashed YE, Durig JR. Infrared and Raman spectra, conformational stability, barriers to internal rotation, normal-coordinate calculations and vibrational assignments for vinyl silyl bromide. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 56: 1065-78. PMID 10845536 DOI: 10.1016/S1386-1425(99)00204-8 |
0.885 |
|
| 2000 |
Durig JR, Robb JB, Xiao J, Gounev TK. Conformational stability of CH3CH2PH2BH3 from temperature dependent FT-IR spectra of xenon solutions and r0 structural parameters. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 56: 29-46. PMID 10728854 DOI: 10.1016/S1386-1425(99)00107-9 |
0.787 |
|
| 2000 |
Durig JR, Shen S, Drew BR, Zhao W. Conformational studies of cyclopropylmethyl ketone from temperature-dependent FT-IR spectra of xenon solutions Structural Chemistry. 11: 213-228. DOI: 10.1023/A:1009282225010 |
0.873 |
|
| 2000 |
Jin Y, Guirgis GA, Durig JR. Structural Chemistry. 11: 229-240. DOI: 10.1023/A:1009258109080 |
0.695 |
|
| 2000 |
Guirgis GA, Zhu X, Yu Z, Durig JR. Raman and Infrared Spectra, Conformational Stability, Normal Coordinate Analysis, Vibrational Assignment, and ab Initio Calculations of 3,3-Difluorobutene The Journal of Physical Chemistry A. 104: 4383-4393. DOI: 10.1021/jp993430o |
0.575 |
|
| 2000 |
Bell S, Groner P, Guirgis GA, Durig JR. Far-Infrared Spectrum, ab Initio, and DFT Calculations and Two-Dimensional Torsional Potential Function of Dimethylallene (3-Methyl-1,2-butadiene) The Journal of Physical Chemistry A. 104: 514-520. DOI: 10.1021/jp993376b |
0.407 |
|
| 2000 |
Durig JR, Yu Z, Guirgis GA. Raman and Infrared Spectra, Conformational Stability, Barriers To Internal Rotation, Normal Coordinate Analysis, Vibrational Assignment, and ab Initio Calculations of 3,3-Difluoropropene The Journal of Physical Chemistry A. 104: 741-751. DOI: 10.1021/jp992560u |
0.577 |
|
| 2000 |
Guirgis GA, Zhen H, Robb JB, Durig JR. Far infrared spectrum, barrier to internal rotation, and ab initio calculations for 3,3,3-trifluoropropene Vibrational Spectroscopy. 23: 137-150. DOI: 10.1016/S0924-2031(00)00058-8 |
0.626 |
|
| 2000 |
Durig J, Hester R, Robb II J. Conformational stability of 1-bromo-2-fluoroethane from temperature dependent FT-IR spectra of rare gas solutions Journal of Molecular Structure: Theochem. 500: 293-309. DOI: 10.1016/S0166-1280(00)00392-4 |
0.723 |
|
| 2000 |
Durig J, Zhao W, Zhu X. Microwave spectrum, ab initio calculations, and structural parameters of bromocyclopentane Journal of Molecular Structure. 521: 25-35. DOI: 10.1016/S0022-2860(99)00423-8 |
0.626 |
|
| 2000 |
Durig JR, Dakkouri M, Gounev TK, Zhen P. Infrared and Raman spectra, conformational stability, and ab initio calculations of cyclobutyl trifluorosilane Journal of Molecular Structure. 516: 161-175. DOI: 10.1016/S0022-2860(99)00195-7 |
0.729 |
|
| 2000 |
Durig J, Robb J, Xiao J, Gounev T. Conformational stability of CH3CH2P(Z)F2(Z=O,S) from temperature dependent FT-IR spectra of rare gas solutions and ro structural parameters Journal of Molecular Structure. 516: 131-152. DOI: 10.1016/S0022-2860(99)00194-5 |
0.738 |
|
| 2000 |
Horn A, Klaeboe P, Aleksa V, Gruodis A, Nielsen CJ, Nashed YE, Guirgis GA, Durig JR. Conformational equilibrium in dimethyl vinyl fluorosilane studied by infrared and Raman spectroscopy Journal of Molecular Structure. 554: 251-269. DOI: 10.1016/S0022-2860(00)00677-3 |
0.882 |
|
| 2000 |
Durig J, Gounev T, Zhen H, Drew A, Shen S, Guirgis G. Raman and infrared spectra, conformational stability, normal coordinate analysis, vibrational assignment, and ab initio calculations of trans -3-pentenenitrile Journal of Molecular Structure. 553: 221-234. DOI: 10.1016/S0022-2860(00)00574-3 |
0.721 |
|
| 2000 |
Bell S, Drew BR, Guirgis GA, Durig JR. The far infrared spectrum, ab initio calculations and conformational energy differences of 1-butene Journal of Molecular Structure. 553: 199-219. DOI: 10.1016/S0022-2860(00)00572-X |
0.855 |
|
| 2000 |
Durig JR, Xiao J. Conformational stabilities of dimethylmethoxyphosphine and dimethyl(methylthio)phosphine from temperature dependent infrared spectra of rare gas solutions Journal of Molecular Structure. 526: 373-389. DOI: 10.1016/S0022-2860(00)00532-9 |
0.767 |
|
| 2000 |
Wurrey CJ, Ko C-, Guirgis GA, Durig JR. Conformational stability, structural parameters, and vibrational frequency assignments of ethylcyclobutane using infrared and Raman spectroscopy and ab initio calculations Journal of Molecular Structure. 550: 1-20. DOI: 10.1016/S0022-2860(00)00511-1 |
0.684 |
|
| 2000 |
Durig JR, Nashed YE, Qtaitat MA, Guirgis GA. Spectra and structure of silicon containing compounds. XXVI. Raman and infrared spectra, r(o) structural parameters, conformational stability, vibrational assignment, and ab initio calculations of vinyl silyl chloride Journal of Molecular Structure. 525: 191-208. DOI: 10.1016/S0022-2860(00)00407-5 |
0.896 |
|
| 2000 |
Guirgis GA, Bell S, Durig JR. Raman and infrared spectra, vibrational assignment, internal rotational barrier andab initio calculations for 3,3-difluoro-1-butyne Journal of Raman Spectroscopy. 31: 987-994. DOI: 10.1002/1097-4555(200011)31:11<987::Aid-Jrs632>3.0.Co;2-M |
0.671 |
|
| 2000 |
Aleksa V, Klaeboe P, Nielsen CJ, Gruodis A, Guirgis GA, Herzog K, Salzer R, Durig JR. The conformers of chloromethylmethyldifluorosilane studied by vibrational spectroscopy andab initio methods Journal of Raman Spectroscopy. 31: 897-907. DOI: 10.1002/1097-4555(200010)31:10<897::Aid-Jrs607>3.0.Co;2-I |
0.559 |
|
| 2000 |
Durig JR, Durig DT, Robb JB, Guirgis GA, Zhen M, Phan HV. Raman and infrared spectra, conformational stability, andab initio calculations for chloromethyl methyl sulfide Journal of Raman Spectroscopy. 31: 203-215. DOI: 10.1002/(Sici)1097-4555(200003)31:3<203::Aid-Jrs515>3.0.Co;2-A |
0.699 |
|
| 2000 |
Durig JR, Zhou L, Schwartz T, Gounev T. Fourier transform Raman spectrum, vibrational assignment andab initio calculation of methanesulfonic acid in the gas and liquid phases Journal of Raman Spectroscopy. 31: 193-202. DOI: 10.1002/(Sici)1097-4555(200003)31:3<193::Aid-Jrs514>3.0.Co;2-7 |
0.492 |
|
| 2000 |
Lee MJ, Fusheng F, Hur SW, Liu J, Gounev TK, Durig JR. Raman and infrared spectra, conformational stability, normal coordinate analysis andab initio calculations of 3-chloro-1-butene Journal of Raman Spectroscopy. 31: 157-169. DOI: 10.1002/(Sici)1097-4555(200003)31:3<157::Aid-Jrs513>3.0.Co;2-2 |
0.865 |
|
| 1999 |
Mohamed TA, Guirgis GA, Nashed YE, Durig JR. Structural Chemistry. 10: 333-348. DOI: 10.1023/A:1022087310109 |
0.869 |
|
| 1999 |
Guirgis GA, Nashed YE, Klaeboe P, Aleksa V, Durig JR. Structural Chemistry. 10: 1-15. DOI: 10.1023/A:1022061710477 |
0.884 |
|
| 1999 |
Durig JR, Durig DT, van der Veken BJ, Herrebout WA. Conformational Stability from Temperature-Dependent FT-IR Spectra of Liquid Rare Gas Solutions, Barriers To Internal Rotation, Vibrational Assignment, and Ab Initio Calculations for 3-Chloropropene The Journal of Physical Chemistry A. 103: 6142-6150. DOI: 10.1021/Jp990831V |
0.561 |
|
| 1999 |
van der Veken BJ, Herrebout WA, Durig DT, Zhao W, Durig JR. Conformational Stability of 3-Fluoropropene in Rare Gas Solutions from Temperature-Dependent FT-IR Spectra and ab Initio Calculations The Journal of Physical Chemistry A. 103: 1976-1985. DOI: 10.1021/Jp9835162 |
0.581 |
|
| 1999 |
Guirgis GA, Wurrey CJ, Yu Z, Zhu X, Durig JR. Conformational Studies of Cyclopropylmethylacetylene from Temperature Dependent FT-IR Spectra of Xenon Solutions and Ab Initio Calculations The Journal of Physical Chemistry A. 103: 1509-1517. DOI: 10.1021/jp9834558 |
0.506 |
|
| 1999 |
Guirgis GA, Gounev TK, Zhen P, Durig JR. Infrared and Raman spectra, conformational stability, normal coordinate analysis, ab initio calculations, and vibrational assignment of 1-fluoro-1-methylsilacyclobutane Spectrochimica Acta - Part a: Molecular and Biomolecular Spectroscopy. 55: 2753-2769. DOI: 10.1016/S1386-1425(99)00092-X |
0.748 |
|
| 1999 |
Bell S, Guirgis GA, Won Hur S, Durig JR. Infrared and Raman spectra and ab initio calculations for 2-pentyne Spectrochimica Acta Part a: Molecular and Biomolecular Spectroscopy. 55: 2361-2374. DOI: 10.1016/S1386-1425(99)00033-5 |
0.599 |
|
| 1999 |
Guirgis G, Yu Z, Durig J. Infrared and Raman spectra, conformational stability, barrier to internal rotation, and ab initio calculations of 1,1-difluoropropane Journal of Molecular Structure. 509: 307-328. DOI: 10.1016/S0022-2860(99)00230-6 |
0.738 |
|
| 1999 |
Durig J, Yu Z, Guirgis G. Conformational stability, barriers to internal rotation, vibrational assignment, and ab initio calculations of 2,2-difluorobutane Journal of Molecular Structure. 509: 115-135. DOI: 10.1016/S0022-2860(99)00215-X |
0.716 |
|
| 1999 |
Durig JR, Shen S, Zhu X, Wurrey CJ. Conformational and structural studies of chloromethylcyclopropane and bromomethylcyclopropane from temperature dependent FT-IR spectra of xenon solutions and ab initio calculations Journal of Molecular Structure. 485: 501-521. DOI: 10.1016/S0022-2860(99)00094-0 |
0.721 |
|
| 1999 |
Guirgis GA, Nashed YE, Durig JR. Raman and infrared spectra, conformational stability, ab initio calculations and vibrational assignments for 2-chloroethyl silane Journal of Molecular Structure. 510: 13-34. DOI: 10.1016/S0022-2860(99)00033-2 |
0.879 |
|
| 1999 |
Guirgis GA, Nashed YE, Robb JB, Klaeboe P, Zhen P, Durig JR. Conformational stability, vibrational spectra and ab initio calculations for chloromethyl methyl silane and chloromethyl methyl difluorosilane Journal of Molecular Structure. 480: 147-151. DOI: 10.1016/S0022-2860(98)00771-6 |
0.848 |
|
| 1999 |
Guirgis GA, Nashed YE, Klaeboe P, Durig JR. Conformational stabilities, ab initio calculations and structural parameters for 2-chloroethyl silane and 2-chloroethyl trifluorosilane Journal of Molecular Structure. 482: 385-389. DOI: 10.1016/S0022-2860(98)00768-6 |
0.867 |
|
| 1999 |
Gruodis A, Powell DL, Klaeboe P, Nielsen CJ, Guirgis GA, Durig JR, Aleksa V. Infrared and Raman spectra, conformations and ab initio calculations of 1,1,1-trifluoropropyl trifluorosilane Journal of Molecular Structure. 482: 627-632. DOI: 10.1016/S0022-2860(98)00683-8 |
0.651 |
|
| 1999 |
Powell DL, Klaeboe P, Gruodis A, Nielsen CJ, Guirgis GA, Durig JR, Aleksa V. Infrared and Raman spectra, conformations and ab initio calculations of ethyl bromosilane and ethyl dibromosilane Journal of Molecular Structure. 482: 391-396. DOI: 10.1016/S0022-2860(98)00681-4 |
0.667 |
|
| 1999 |
Aleksa V, Herzog K, Salzer R, Gruodis A, Klaeboe P, Nielsen CJ, Guirgis GA, Durig JR. Infrared And Raman Spectra, Conformations And Ab Initio Calculations Of Chloromethyl Methyldifluorosilane Journal of Molecular Structure. 482: 571-577. DOI: 10.1016/S0022-2860(98)00678-4 |
0.636 |
|
| 1999 |
Mastryukov VS, Durig JR. Differences in the central bond lengths versus energy differences for two conformers coexisting in the gas phase: Empirical relation Journal of Molecular Structure. 508: 233-235. DOI: 10.1016/S0022-2860(98)00674-7 |
0.35 |
|
| 1999 |
Durig JR, Hur SW, Gounev TK. Conformational stability, vibrational assignments, and normal coordinate analysis from variable temperature FT-IR spectra of xenon solutions and ab initio calculations of epibromohydrin Journal of Molecular Structure. 478: 57-72. DOI: 10.1016/S0022-2860(98)00667-X |
0.868 |
|
| 1999 |
Durig JR, Galabov B, Johnson RD, Groner P. Spectra and structure of organophosphorus compounds. LXI1. The structures of trans and gauche ethyldifluorophosphine Journal of Molecular Structure. 477: 241-249. DOI: 10.1016/S0022-2860(98)00610-3 |
0.576 |
|
| 1999 |
Durig JR, Yanping J, Pengqian Z, Gounev TK, Guirgis GA. Infrared and Raman spectra, conformational stability, normal coordinate analysis, ab initio calculations, and vibrational assignment of 1–methylsilacyclobutane Journal of Molecular Structure. 477: 31-47. DOI: 10.1016/S0022-2860(98)00602-4 |
0.74 |
|
| 1999 |
Gounev TK, Guirgis GA, Mohamed TA, Zhen P, Durig JR. Raman and infrared spectra, conformational stability, normal coordinate analysis,ab initio calculations and vibrational assignment of 1-chloro-1-methylsilacyclobutane Journal of Raman Spectroscopy. 30: 399-411. DOI: 10.1002/(Sici)1097-4555(199905)30:5<399::Aid-Jrs382>3.0.Co;2-F |
0.736 |
|
| 1999 |
Durig JR, Honeycutt TR, Daeyaert FFD, Robb JB. Spectra and structure of organosphosphorus molecules. Part LX—Raman and infrared spectra, conformational stability,ab initio calculations and vibrational assignment of fluoromethyldichlorophosphine Journal of Raman Spectroscopy. 30: 155-167. DOI: 10.1002/(Sici)1097-4555(199903)30:3<155::Aid-Jrs364>3.0.Co;2-4 |
0.65 |
|
| 1999 |
Groner P, Durig JR, DesMarteau DD, Hwang SH. N-chlorodifluoromethanimine, CF2=NCl: Quadrupole coupling and r0 structure Journal of Chemical Physics. 110: 9411-9417. |
0.327 |
|
| 1998 |
Durig JR, Wang A, Little TS, Brletic PA, Bucenell JR. Conformational Stability, Barriers To Internal Rotation, Vibrational Assignment And Ab Initio Calculations Of 2-Fluoropropenoyl Fluoride Journal of Chemical Physics. 91: 7361-7373. DOI: 10.1063/1.457259 |
0.584 |
|
| 1998 |
Guirgis GA, Nashed YE, Gounev TK, Durig JR. Structural Chemistry. 9: 265-277. DOI: 10.1023/A:1022478913441 |
0.858 |
|
| 1998 |
Mohamed TA, Guirgis GA, Nashed YE, Durig JR. Structural Chemistry. 9: 255-264. DOI: 10.1023/A:1022426829370 |
0.84 |
|
| 1998 |
Gounev TK, Hur SW, Dakkouri M, Grunvogel-Hurst A, Durig JR. Structural Chemistry. 9: 95-112. DOI: 10.1023/A:1022407719801 |
0.629 |
|
| 1998 |
Durig JR, Yu Z, Guirgis GA, Little TS, Zhen M, Lee MJ. Raman and Infrared Spectra, Conformational Stability, Normal Coordinate Analysis, Vibrational Assignment, and AB Initio Calculations of Difluoromethylcyclopropane The Journal of Physical Chemistry A. 102: 10460-10468. DOI: 10.1021/jp982520a |
0.575 |
|
| 1998 |
Guirgis GA, Drew B, Gounev T, Durig J. Conformational stability and vibrational assignment of propanal Spectrochimica Acta Part a: Molecular and Biomolecular Spectroscopy. 54: 123-143. DOI: 10.1016/S1386-1425(97)00200-X |
0.854 |
|
| 1998 |
Durig J, Hur SW, Dakkouri M, Grunvogel-Hurst A, Gounev T. Infrared and Raman spectra, conformational stability, ab initio calculations, and vibrational assignments for cyclopropyldichlorosilane Chemical Physics. 226: 125-141. DOI: 10.1016/S0301-0104(97)00249-8 |
0.88 |
|
| 1998 |
Robb II J, Xiao J, Durig J. Conformational stability of ethyldifluorophosphine-borane from temperature-dependent FT-IR spectra of xenon solutions Journal of Molecular Structure. 449: 255-268. DOI: 10.1016/S0022-2860(98)00464-5 |
0.714 |
|
| 1998 |
Gounev TK, Hur SW, Durig JR. Conformational stability of epifluorohydrin from temperature dependent ft-ir spectra of xenon solutions and ab initio calculations Journal of Molecular Structure. 449: 241-253. DOI: 10.1016/S0022-2860(98)00463-3 |
0.869 |
|
| 1998 |
Wurrey C, Shen S, Zhu X, Zhen H, Durig J. Conformational studies of cyanomethylcyclopropane from temperature-dependent FT-IR spectra of xenon solutions and ab initio calculations Journal of Molecular Structure. 449: 203-217. DOI: 10.1016/S0022-2860(98)00460-8 |
0.642 |
|
| 1998 |
Durig J, Li Y, Shen S, Durig D. Conformational stability and structural parameters of CH3CH2CClO and other (CH3)nCH3−nCClO molecules Journal of Molecular Structure. 449: 131-157. DOI: 10.1016/S0022-2860(98)00457-8 |
0.621 |
|
| 1998 |
Durig JR, Nashed YE, Jin Y, Guirgis GA. Raman and infrared spectra, conformational stability, ab initio calculations and vibrational assignments for dichloromethyl methyl silane Journal of Molecular Structure. 449: 1-22. DOI: 10.1016/S0022-2860(98)00304-4 |
0.881 |
|
| 1998 |
Gounev T, Bell S, Zhou L, Durig J. Conformational studies of 2-fluoroethanol in liquid xenon from temperature dependence FT-IR spectra Journal of Molecular Structure. 447: 21-32. DOI: 10.1016/S0022-2860(98)00294-4 |
0.705 |
|
| 1998 |
Durig J, Guirgis GA, Mohamed TA. Infrared and raman spectra, conformational stability, normal coordinate analysis, ab initio calculations, and vibrational assignment of difluoroacetyl fluoride Journal of Molecular Structure. 444: 165-182. DOI: 10.1016/S0022-2860(97)00383-9 |
0.737 |
|
| 1998 |
Guirgis GA, Nashed YE, Robb JB, Durig JR. Raman and infrared spectra, conformational stability, ab initio calculations and vibrational assignments for chloromethyl methyl silane Journal of Molecular Structure. 446: 15-39. DOI: 10.1016/S0022-2860(97)00346-3 |
0.884 |
|
| 1998 |
Lee MJ, Hur SW, Durig JR. Conformational stability, vibrational assignments, and normal coordinate analysis from FT-IR spectra of xenon solutions and ab initio calculations of epichlorohydrin Journal of Molecular Structure. 444: 99-113. DOI: 10.1016/S0022-2860(97)00344-X |
0.863 |
|
| 1998 |
Durig J, Durig D, Dickson T, Jalilian M, Jin Y, Sullivan J. Infrared and Raman spectra, conformational stability, barriers to internal rotation, vibrational assignment, and ab initio calculations for methyl vinyl sulfide Journal of Molecular Structure. 442: 71-92. DOI: 10.1016/S0022-2860(97)00266-4 |
0.615 |
|
| 1998 |
Galabov B, Dudev T, Ilieva S, Durig JR. Creation of intensity theory in vibrational spectroscopy: Key role of ab initio quantum mechanical calculations International Journal of Quantum Chemistry. 70: 331-339. DOI: 10.1002/(Sici)1097-461X(1998)70:2<331::Aid-Qua9>3.0.Co;2-V |
0.52 |
|
| 1998 |
Durig JR, Xiao J, Robb JB, Daeyaert FFD. Ab initio calculation of the conformational stability, vibrational wavenumbers, Raman and infrared intensities and structural parameters of chloromethyldichlorophosphine Journal of Raman Spectroscopy. 29: 463-472. DOI: 10.1002/(Sici)1097-4555(199806)29:6<463::Aid-Jrs266>3.0.Co;2-Y |
0.723 |
|
| 1998 |
Drew BR, Gounev TK, Guirgis GA, Durig JR. Raman and infrared spectra, conformational stability,ab initio calculations and vibrational assignments for chlorodifluoroacetyl fluoride Journal of Raman Spectroscopy. 29: 205-214. DOI: 10.1002/(Sici)1097-4555(199803)29:3<205::Aid-Jrs226>3.0.Co;2-J |
0.859 |
|
| 1998 |
Durig JR, Daeyaert FFD. Raman and Infrared Spectra, Conformational Stability, Ab Initio Calculations and Vibrational Assignment of Fluoromethyl Phosphonothioic Dichloride Journal of Raman Spectroscopy. 29: 191-203. DOI: 10.1002/(Sici)1097-4555(199803)29:3<191::Aid-Jrs225>3.0.Co;2-S |
0.713 |
|
| 1997 |
Gounev TK, Weston JW, Shen S, Dakkouri M, Grunvogel-Hurst A, Durig JR. Infrared and Raman Spectra, Conformational Stability,abInitioCalculations, and Vibrational Assignments for Cyclopropylchlorosilane The Journal of Physical Chemistry A. 101: 8614-8624. DOI: 10.1021/jp971894l |
0.53 |
|
| 1997 |
Durig JR, Guirgis GA, Bell S, Brewer WE. Far-Infrared Spectrum, ab Initio Calculations, Conformational Energy Differences, Barriers to Internal Rotation, andr0Structure of Propanal† The Journal of Physical Chemistry A. 101: 9240-9252. DOI: 10.1021/jp971106s |
0.476 |
|
| 1997 |
Bell S, Guirgis GA, Li Y, Durig JR. Far Infrared Spectrum,ab InitioCalculations, and Conformational Analysis of 1-Pentyne The Journal of Physical Chemistry A. 101: 5987-5996. DOI: 10.1021/jp970163i |
0.481 |
|
| 1997 |
Dakkouri M, Grunvogel-Hurst A, Guirgis GA, Yu Z, Jin Y, Durig JR. Infrared and Raman spectra, vibrational assignment, and ab initio calculations of fluoromalononitrile Spectrochimica Acta Part a: Molecular and Biomolecular Spectroscopy. 53: 2001-2012. DOI: 10.1016/S1386-1425(97)00119-4 |
0.662 |
|
| 1997 |
Durig JR, Zhou L, Gounev T, Guirgis GA. Vibrational spectra, conformational stability and ab initio calculations of chlorosulfonyl isocyanate Spectrochimica Acta Part a: Molecular and Biomolecular Spectroscopy. 53: 1581-1593. DOI: 10.1016/S1386-1425(97)00006-1 |
0.69 |
|
| 1997 |
Durig JR, Shen Z. Vibrational spectra and structure from ab initio calculations of tetrafluorodiphosphine Vibrational Spectroscopy. 13: 195-203. DOI: 10.1016/S0924-2031(96)00048-3 |
0.692 |
|
| 1997 |
Guirgis GA, Jin Y, Klaeboe P, Durig J. Infrared and Raman spectra, conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignments for dichlorofluoroacetyl fluoride Chemical Physics. 223: 131-148. DOI: 10.1016/S0301-0104(97)00236-X |
0.585 |
|
| 1997 |
Durig J, Shen Z. Investigation of the structure, bonding, vibrational frequencies and stability by ab initio calculations of H3BPH3, H3BPHF2, and H3BPF3 Journal of Molecular Structure: Theochem. 397: 179-190. DOI: 10.1016/S0166-1280(96)04940-8 |
0.516 |
|
| 1997 |
Gounev TK, Guirgis GA, Durig JR. Vibrational spectra, conformational stability and ab initio calculations of trifluoromethylsulfonyl isocyanate Journal of Molecular Structure. 613-625. DOI: 10.1016/S0022-2860(97)00223-8 |
0.712 |
|
| 1997 |
Durig JR, Robb JB. Spectra and structure of organophosphorus compounds LIX: Conformational stability from temperature dependent FT-IR spectra of xenon solutions and ab initio calculations for ethyldifluorophosphine Journal of Molecular Structure. 413: 371-385. DOI: 10.1016/S0022-2860(97)00169-5 |
0.74 |
|
| 1997 |
Guirgis GA, Shen Z, Durig JR, Durig DT, Qtaitat MA, Drew AS, Jin Y. Spectra and structure of silicon containing compounds of the general formula CH2CHSi(CH3)(n)Cl(3-n) Journal of Molecular Structure. 410: 431-434. DOI: 10.1016/S0022-2860(96)09698-6 |
0.592 |
|
| 1997 |
Durig JR, Robb JB, Gounev TK. Temperature dependent FT-IR spectra of xenon solutions and ab initio calculations for the determinations of conformational stabilities of some CH3CH2PX2 molecules Journal of Molecular Structure. 71-79. DOI: 10.1016/S0022-2860(96)09653-6 |
0.735 |
|
| 1997 |
Durig J, Shen S, Zhao W, Zhou L. Conformational studies of cyclopropylcarbonyl chloride from temperature-dependent FT-IR spectra of xenon solutions Journal of Molecular Structure. 407: 11-26. DOI: 10.1016/S0022-2860(96)09650-0 |
0.669 |
|
| 1997 |
Wurrey CJ, Shen S, Gounev T, Durig JR. Conformational stability of ethylcyclopropane from Raman spectra, temperature dependent FT-IR spectra of xenon solutions and ab initio calculations Journal of Molecular Structure. 406: 207-218. DOI: 10.1016/S0022-2860(96)09605-6 |
0.692 |
|
| 1997 |
Durig JR, Robb JB. Conformational stability from temperature-dependent FT-IR spectra of xenon solutions and ab initio calculations for ethyldichlorophosphine Journal of Molecular Structure. 406: 191-205. DOI: 10.1016/S0022-2860(96)09604-4 |
0.735 |
|
| 1997 |
Jensen HM, Klaeboe P, Guirgis GA, Aleksa V, Nielsen CJ, Durig JR. The Vibrational Spectra And Conformers Of Chloromethyl Dimethyl Chlorosilane Journal of Molecular Structure. 483-488. DOI: 10.1016/S0022-2860(96)09459-8 |
0.632 |
|
| 1997 |
Guirgis GA, Nilsen A, Klaeboe P, Aleksa V, Nielsen CJ, Durig JR. The vibrational spectra, including matrix isolation, conformations and ab initio calculations of bromomethyl dimethyl chlorosilane Journal of Molecular Structure. 477-481. DOI: 10.1016/S0022-2860(96)09458-6 |
0.68 |
|
| 1997 |
Durig JR, Guirgis GA, Phan HV, Li Y. Conformational stability, barriers to internal rotation, vibrational assignment and ab initio calculations of 2-methylpropionyl chloride Journal of Molecular Structure. 406: 169-189. DOI: 10.1016/S0022-2860(96)09442-2 |
0.723 |
|
| 1997 |
Durig J, Robb J, Gounev T. Utility of temperature dependent FT-IR spectra of xenon solutions and ab initio calculations for conformational stability determinations of some CH3YPX2 molecules Journal of Molecular Structure. 405: 45-58. DOI: 10.1016/S0022-2860(96)09427-6 |
0.705 |
|
| 1997 |
Guirgis GA, Shens Z, Qtaitat MA, Durig J. Spectra and structure of silicon containing compounds: XXIII. Raman and infrared spectra, conformational stability, vibrational assignment and ab initio calculations of dimethyl vinyl chlorosilane Journal of Molecular Structure. 403: 57-71. DOI: 10.1016/S0022-2860(96)09400-8 |
0.72 |
|
| 1997 |
Guirgis GA, Eltayeb S, Li Y, Durig JR. Infrared and Raman spectra, conformational stability, vibrational assignment, and ab initio calculations of 2-bromo-3-chloropropene Journal of Molecular Structure. 403: 39-56. DOI: 10.1016/S0022-2860(96)09350-7 |
0.702 |
|
| 1997 |
Durig JR, Shen Z. Investigation of the structure, bonding, vibrational frequencies and stability by ab initio calculations of H3BPH3, H3BPHF2, and H3BPF3 Journal of Molecular Structure: Theochem. 397: 179-190. |
0.424 |
|
| 1997 |
Durig JR, Shen Z. Conformational stability of tetrafluorohydrazine, N2F4 Journal of Physical Chemistry A. 101: 5010-5016. |
0.66 |
|
| 1996 |
Durig JR, Bell S, Guirgis GA. Infrared and Raman spectra, conformational stability, ab initio calculations and vibrational assignment for 1,2-pentadiene (ethyl allene) Spectrochimica Acta Part a: Molecular and Biomolecular Spectroscopy. 52: 1843-1859. DOI: 10.1016/S0584-8539(96)01740-0 |
0.661 |
|
| 1996 |
Guirgis GA, Bell S, Durig JR. Infrared and Raman spectra, ab initio calculations and vibrational assignment for 3-fluoro-1-butyne Spectrochimica Acta Part a: Molecular and Biomolecular Spectroscopy. 52: 1861-1873. DOI: 10.1016/S0584-8539(96)01739-4 |
0.665 |
|
| 1996 |
Durig J, Li Y, Jin Y. Conformational studies of propenoyl chloride in liquid xenon from temperature dependent FT-IR spectra Chemical Physics. 213: 181-192. DOI: 10.1016/S0301-0104(96)00285-6 |
0.683 |
|
| 1996 |
Durig J, Shen S, Zhao W, Zhou L. Conformational studies of cyclopropylcarbonyl fluoride from temperature dependent FT-IR spectra of xenon solutions Chemical Physics. 213: 165-179. DOI: 10.1016/S0301-0104(96)00242-X |
0.398 |
|
| 1996 |
Durig J, Shen Z, Zhao W. Conformational stability, structural parameters, and vibrational frequencies from ab initio calculations for biphosphine Journal of Molecular Structure. 375: 95-104. DOI: 10.1016/S0166-1280(96)91253-1 |
0.642 |
|
| 1996 |
Durig JR, Robb JB. Spectra and structure of organophosphorus compounds. LVII. Raman and infrared spectra, conformational stability, and ab initio calculations for methoxydifluorophosphine Journal of Molecular Structure. 375: 53-66. DOI: 10.1016/S0166-1280(96)91199-9 |
0.712 |
|
| 1996 |
Guirgis GA, Hsu YD, Vlaservich AC, Stidham HD, Durig JR. Vibrational spectrum, ab initio calculations, assignments of fundamentals, barriers to internal rotation and stabilities of conformers of 1,2-dichloropropane Journal of Molecular Structure. 378: 83-102. DOI: 10.1016/S0166-1280(96)91003-9 |
0.807 |
|
| 1996 |
Durig J, Zhou L, Gounev T, Klaeboe P, Guirgis GA, Wang L. Far infrared spectra, conformational equilibria, vibrational assignments and ab initio calculations of 2-chloroethanol Journal of Molecular Structure. 385: 7-21. DOI: 10.1016/S0022-2860(96)09336-2 |
0.612 |
|
| 1996 |
Guirgis GA, Zhou L, Gounev T, Durig JR. Vibrational spectra, conformational stability and ab initio calculations of fluorosulfonyl isocyanate Vibrational Spectroscopy. 12: 177-188. DOI: 10.1016/0924-2031(96)00029-X |
0.57 |
|
| 1996 |
Gounev TK, Durig JR. Spectra and structure of organophosphorus compounds. LVII. Raman and infrared spectra, conformational stability, vibrational assignment and ab initio calculations of n-propyltetrafluorophosphorane Chemical Physics. 205: 109-126. DOI: 10.1016/0301-0104(95)00351-7 |
0.741 |
|
| 1996 |
Durig JR, Guirgis GA, Kim YH, Yan W, Qtaitat MA. Spectra and structure of silicon containing compounds. XXII. Raman and infrared spectra, conformational stability, vibrational assignment and ab initio calculations of methylvinyldichlorosilane Journal of Molecular Structure. 382: 111-127. DOI: 10.1016/0022-2860(96)09257-5 |
0.561 |
|
| 1996 |
Durig JR, Shen S, Gounev T, Wurrey CJ. Conformational behavior of ethyloxirane from infrared and Raman spectra, temperature dependent FT-IR spectra of xenon solutions, and ab initio calculations Journal of Molecular Structure. 379: 267-282. DOI: 10.1016/0022-2860(96)09250-2 |
0.704 |
|
| 1996 |
Durig JR, Guirgis GA, Jin Y. Raman and infrared spectra, conformational stability, vibrational assignment and ab initio calculations of but-2-enoyl fluoride Journal of Molecular Structure. 379: 151-170. DOI: 10.1016/0022-2860(95)09149-1 |
0.622 |
|
| 1996 |
Durig JR, Guirgis GA, Jin Y. Raman and infrared spectra, conformational stability, barriers to internal rotation and ab initio calculations for 3-methyl-2-butenoyl chloride Journal of Molecular Structure. 376: 261-275. DOI: 10.1016/0022-2860(95)09124-6 |
0.717 |
|
| 1996 |
Ilieva S, Krusteva M, Dudev T, Galabov B, Gounev T, Durig J. Effective bond charges from infrared intensities: ab initio calculations Journal of Molecular Structure. 377: 75-79. DOI: 10.1016/0022-2860(95)09104-1 |
0.437 |
|
| 1996 |
Durig J, Davis J, Wang A. Conformational stability, barriers to internal rotation, vibrational assignment and ab initio calculations of oxalyl chloride Journal of Molecular Structure. 375: 67-81. DOI: 10.1016/0022-2860(95)09048-7 |
0.697 |
|
| 1996 |
Durig J, Little T, Gounev T, Gardner J, Sullivan JF. Infrared and Raman spectra, conformational stability, vibrational assignment, and ab initio calculations of chloromethyl isocyanate Journal of Molecular Structure. 375: 83-94. DOI: 10.1016/0022-2860(95)08983-7 |
0.684 |
|
| 1996 |
Durig DT, Herrebout WA, Qiu HZ, Zhen M, Durig JR. Raman and infrared spectra, conformational stability, and ab initio calculations of trans -1-fluoro-2-butene Structural Chemistry. 7: 1-15. DOI: 10.1007/Bf02275446 |
0.478 |
|
| 1996 |
Durig JR, Davis JF, Groner MD, Wang A. Raman and Far-Infrared Spectra, Conformational Stability and Ab Initio Calculations for Oxalyl Fluoride Journal of Raman Spectroscopy. 27: 841-852. DOI: 10.1002/(sici)1097-4555(199611)27:11<841::aid-jrs41>3.0.co;2-0 |
0.561 |
|
| 1996 |
Durig JR, Drew AS, Guirgis GA. Raman and Infrared Spectra, Barrier to Internal Rotation, Vibrational Assignment and Ab Initio Calculations of 2,3,3,3-Tetrafluoropropionitrile Journal of Raman Spectroscopy. 27: 127-136. DOI: 10.1002/(Sici)1097-4555(199602)27:2<127::Aid-Jrs934>3.0.Co;2-A |
0.621 |
|
| 1996 |
Eltayeb S, Guirgis GA, Fanning AR, Durig JR. Raman and Far-Infrared Spectra, Barriers to Internal Rotation and Ab Initio Calculations of CF3CF2X, where X=H, Cl, Br, and I Journal of Raman Spectroscopy. 27: 111-126. DOI: 10.1002/(Sici)1097-4555(199602)27:2<111::Aid-Jrs935>3.0.Co;2-Q |
0.524 |
|
| 1995 |
Durig JR, Klaeboe P, Guirgis GA, Wang L, Liu J. Far Infrared Spectra, Conformational Equilibrium, Barriers to Internal Rotation, Vibrational Assignment andab initioCalculations of 2-Fluoroethanol Zeitschrift FüR Physikalische Chemie. 191: 23-45. DOI: 10.1524/zpch.1995.191.Part_1.023 |
0.524 |
|
| 1995 |
Guirgis GA, Qtaitat MA, Pentin YA, Whang CM, Sullivan JF, Durig JR, Klaeboe P. Spectra and structure of silicon containing compounds Fresenius' Journal of Analytical Chemistry. 352: 499-507. DOI: 10.1016/S0924-2031(01)00091-1 |
0.673 |
|
| 1995 |
Durig JR, Groner P, Honeycutt TR, Daeyaert FFD. Spectra and structure of organophosphorus compounds. LVI. Vibrational spectra, conformational stability, ab initio calculations, and vibrational assignment of fluoromethyl phosphonic difluoride Chemical Physics. 201: 363-380. DOI: 10.1016/0301-0104(95)00230-8 |
0.673 |
|
| 1995 |
Durig JR, Badawi HM, Durig DT. Spectra and structure of small ring compounds. LXV. Conformational stability, barriers to inversion, ab initio calculations and vibrational assignment of chlorocyclopentane Journal of Molecular Structure: Theochem. 338: 267-281. DOI: 10.1016/0166-1280(94)04066-2 |
0.75 |
|
| 1995 |
Herrebout W, van der Veken B, Durig J. On the angular geometry of the CH3Cl · HCl van der Waals complex in the gas phase and in liquefied noble gas solutions Journal of Molecular Structure: Theochem. 332: 231-240. DOI: 10.1016/0166-1280(94)03956-L |
0.482 |
|
| 1995 |
Durig J, Gounev T, Braathens O. Spectra and structure of organophosphorus compounds. LV. Microwave spectrum, structure, and ab initio calculations of ethylphosphonic difluoride Journal of Molecular Structure. 355: 159-168. DOI: 10.1016/0022-2860(95)08897-5 |
0.629 |
|
| 1995 |
Durig J, Guirgis GA, Badejo I, Davis J. Conformational stability, barriers to internal rotation, vibrational assignment, structural parameters, and ab initio calculations of oxalyl chlorofluoride Journal of Molecular Structure. 354: 15-28. DOI: 10.1016/0022-2860(95)08815-D |
0.714 |
|
| 1995 |
Durig J, Guirgis GA, Krutules K. Raman and infrared spectra, conformational stability, barriers to internal rotation, and ab initio calculations of bromocarbonyl isocyanate Journal of Molecular Structure. 354: 1-14. DOI: 10.1016/0022-2860(95)08814-C |
0.714 |
|
| 1995 |
Durig DT, Herrebout WA, Zhen M, Durig JR. Conformational stability of trans-1-fluoro-2-butene Journal of Molecular Structure. 349: 1-4. DOI: 10.1016/0022-2860(95)08694-Q |
0.613 |
|
| 1995 |
Durig J, Robb J, Honeycutt T, Daeyaert F, Herrebout W, van der Veken B. Vibrational spectra, conformational stability, and ab initio calculations of fluoromethyl, ethyl and methoxy dichlorophosphine Journal of Molecular Structure. 348: 213-216. DOI: 10.1016/0022-2860(95)08627-8 |
0.622 |
|
| 1995 |
Durig J, Davis J, Guirgis G. Conformational stability, barriers to internal rotation, ab initio calculations, and vibrational assignment for fluorodichloroacetyl chloride Journal of Molecular Structure. 346: 197-214. DOI: 10.1016/0022-2860(94)09014-G |
0.709 |
|
| 1995 |
Durig J, Zhao W, Zhu X, Geyer T, Dakkouri M. Spectra and structure of small ring compounds. LXV. Raman and infrared spectra, conformational stability, and vibrational assignment of cyclopentylsilane Journal of Molecular Structure. 351: 31-49. DOI: 10.1016/0022-2860(94)08484-Y |
0.67 |
|
| 1995 |
Chatterjee K, Durig J. Spectra and structure of organophosphorus compounds. LIV. Microwave spectrum, ab initio calculations and structure of methylphosphonothioic difluoride Journal of Molecular Structure. 351: 25-29. DOI: 10.1016/0022-2860(94)08483-X |
0.544 |
|
| 1995 |
Durig JR, Gounev TK. Spectra and structure of organophosphorus compounds. LIII. Infrared and Raman spectra, conformational stability, vibrational assignment and ab initio calculations of n-propyldichlorophosphine Journal of Molecular Structure. 350: 19-42. DOI: 10.1016/0022-2860(94)08442-K |
0.728 |
|
| 1995 |
Guirgis GA, Qtaitat MA, Pentin YA, Whang CM, Sullivan JF, Durig JR, Klaeboe P. Spectra and structure of silicon containing compounds. XXI: Infrared and raman spectra, conformational stability, ab initio calculations and vibrational assignments for chlorodimethylmethoxysilane Fresenius Journal of Analytical Chemistry. 352: 499-507. DOI: 10.1007/Bf00323375 |
0.712 |
|
| 1995 |
Durig JR, Eltayeb S, Guirgis GA. Raman and infrared spectra, barriers to internal rotation, vibrational assignment and ab initio calculations of 1-bromo-2-methylpropene Journal of Raman Spectroscopy. 26: 945-953. DOI: 10.1002/Jrs.1250261004 |
0.661 |
|
| 1995 |
Durig JR, Drew AS, Guirgis GA. Raman and infrared spectra, vibrational assignment and ab initio calculations of trans-2-methyl-2-butenenitrile Journal of Raman Spectroscopy. 26: 933-943. DOI: 10.1002/Jrs.1250261003 |
0.649 |
|
| 1995 |
Chatterjee KK, Durig JR. Raman and infrared spectra, ab initio calculations and normal coordinate analysis of boranedimethyl sulfide Journal of Raman Spectroscopy. 26: 855-860. DOI: 10.1002/Jrs.1250260836 |
0.621 |
|
| 1995 |
Durig JR, Guirgis GA, Krutules KA. Raman and infrared spectra, conformational stability, barriers to internal rotation and ab initio calculations of trifluoroacetyl isothiocyanate Journal of Raman Spectroscopy. 26: 475-486. DOI: 10.1002/jrs.1250260612 |
0.563 |
|
| 1995 |
Durig JR, Guirgis GA, Qtaitat MA. Spectra and structures of silicon-containing compounds. XX-Raman and infrared spectra, conformational stability, vibrational assignment and ab Initio calculations of methylvinyldifluorosilane Journal of Raman Spectroscopy. 26: 413-426. DOI: 10.1002/Jrs.1250260605 |
0.703 |
|
| 1995 |
Durig JR, Groner P, Drew AS, Guirgis GA, van der Veken BJ. Raman and infrared spectra, conformational stability, vibrational assignment and ab initio calculations of methyl cyanoformate Journal of Raman Spectroscopy. 26: 43-55. DOI: 10.1002/Jrs.1250260109 |
0.644 |
|
| 1995 |
Durig JR, Guirgis GA, Drew AS. Raman and infrared spectra, conformational analysis, ab initio calculations and vibrational assignment of 3-bromopropionitrile Journal of Raman Spectroscopy. 26: 15-26. DOI: 10.1002/Jrs.1250260105 |
0.725 |
|
| 1994 |
Church J, Durig J, Mohamed TA, Mohamad AB. Spectra and structure of silicon compounds. XVII Raman and infrared spectra and vibrational assignment for hexamethyldisilane and ab initio calculations for disilane and hexamethyldisilane Spectrochimica Acta Part a: Molecular Spectroscopy. 50: 639-660. DOI: 10.1016/0584-8539(94)80175-4 |
0.512 |
|
| 1994 |
Qtaitat MA, Mohamad AB, Mohamed TA, Gerson D, McArver A, Afifi M, Durig J. Spectra and structure of silicon-containing compounds. XVII. Vibrational and microwave spectra, molecular structure, barrier to internal rotation and ab initio calculations of methyltrichlorosilane Spectrochimica Acta Part a: Molecular Spectroscopy. 50: 621-637. DOI: 10.1016/0584-8539(94)80174-6 |
0.496 |
|
| 1994 |
Durig J, Kim YH, Little T. Conformational stability of trivinylborane from vibrational spectra and ab initio calculations Spectrochimica Acta Part a: Molecular Spectroscopy. 50: 609-619. DOI: 10.1016/0584-8539(94)80173-8 |
0.57 |
|
| 1994 |
Wang A, Little T, Durig J. Spectra and structure of small ring compounds. LXII. Conformational stability, structural parameters, ab initio calculations and vibrational assignment of cyclopropylmethyl ketone Spectrochimica Acta Part a: Molecular Spectroscopy. 50: 595-607. DOI: 10.1016/0584-8539(94)80172-X |
0.509 |
|
| 1994 |
Durig D, Qiu HZ, Zhen M, Little T, Durig J. Microwave and far-IR spectra, conformational stability, molecular structure, barriers to internal rotation and ab initio calculations for the anticlinal conformer of trans-1-fluoro-2-butene Spectrochimica Acta Part a: Molecular Spectroscopy. 50: 583-593. DOI: 10.1016/0584-8539(94)80171-1 |
0.54 |
|
| 1994 |
Hizer T, Rizzolo J, Ives J, Durig J. Analysis of torsional spectra of molecules with two internal C3ν, rotors—XXVI. A far infrared study of 1,1-dimethylhydrazine Spectrochimica Acta Part a: Molecular Spectroscopy. 50: 521-538. DOI: 10.1016/0584-8539(94)80166-5 |
0.396 |
|
| 1994 |
Durig JR, Kim YH, Guirgis GA, McDonald JK. FT-Raman and infrared spectra, r0 structural parameters, ab initio calculations and vibrational assignment for nitryl chloride Spectrochimica Acta Part a: Molecular Spectroscopy. 50: 463-472. DOI: 10.1016/0584-8539(94)80161-4 |
0.571 |
|
| 1994 |
Sullivan J, Heusel H, Zunic W, Durig J, Cradock S. Structure, vibrational assignment, normal coordinate analysis, and ab initio calculations of methylisocyanate Spectrochimica Acta Part a: Molecular Spectroscopy. 50: 435-447. DOI: 10.1016/0584-8539(94)80159-2 |
0.477 |
|
| 1994 |
Durig JR, Phan HV, Bergana MM, Rollins MS, Gulick JM, Odom JD, Hudson SD. Infrared and Raman spectra, conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment of ethyl methyl selenide Spectrochimica Acta Part a: Molecular Spectroscopy. 50: 399-419. DOI: 10.1016/0584-8539(94)80157-6 |
0.663 |
|
| 1994 |
Badawi HM, Baranovic G, Groner P, Zhen M, Durig JR. Raman spectra, conformational stability, structural parameters, vibrational assignment, and ab initio calculations for epifluorohydrin Spectrochimica Acta Part a: Molecular Spectroscopy. 50: 383-397. DOI: 10.1016/0584-8539(94)80156-8 |
0.654 |
|
| 1994 |
Durig JR, Giurgis GA, Krutules K. Raman and infrared spectra, conformational stability, and ab initio calculations of acetyl isothiocyanate Journal of Molecular Structure. 328: 97-114. DOI: 10.1016/0022-2860(94)08388-6 |
0.738 |
|
| 1994 |
Durig J, Giurgis G, Krutules K. Raman and infrared spectra, conformational stability, barriers to internal rotation, and ab initio calculations of trifluoroacetyl isocyanate Journal of Molecular Structure. 328: 55-75. DOI: 10.1016/0022-2860(94)08362-2 |
0.691 |
|
| 1994 |
Durig J, Zhao W, Little T, Zhu X, Dakkouri M, Grosser M. Spectra and structures of small ring compounds. LXIV. Raman and infrared spectra, vibrational assignment, and ab initio calculations of 1,1-diethynylsilacyclobutane Journal of Molecular Structure. 328: 77-96. DOI: 10.1016/0022-2860(94)08361-4 |
0.679 |
|
| 1994 |
Durig JR, Robb JB, Little TS. Spectra and structure of organophosphorus compounds Part LII. Raman and infrared spectra, conformational stability, and ab initio calculations for methoxydichlorophosphine Journal of Molecular Structure. 328: 37-54. DOI: 10.1016/0022-2860(94)08359-2 |
0.682 |
|
| 1994 |
Durig J, Davis J, Guirgis G. Conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment for chlorodifluoroacetyl chloride Journal of Molecular Structure. 328: 19-35. DOI: 10.1016/0022-2860(94)08357-6 |
0.701 |
|
| 1994 |
Durig J, Gounev T, Lee M, Little T. Spectra and structure of organophosphorus compounds. LI. IR and Raman spectra, conformational stability, barriers to internal rotation, vibrational assignment, and ab initio calculations of n-propylphosphine Journal of Molecular Structure. 327: 23-53. DOI: 10.1016/0022-2860(94)08354-1 |
0.72 |
|
| 1994 |
Durig JR, Guirgis GA, Drew AS. Conformational analysis, ab initio calculations, and vibrational assignment of 3-chloropropionitrile Journal of Molecular Structure. 327: 55-69. DOI: 10.1016/0022-2860(94)08352-5 |
0.729 |
|
| 1994 |
Durig J, Guirgis G, Eltayeb S. Raman and infrared spectra, structure, vibrational assignment, normal coordinate analysis, and ab initio calculations of trifluoromethyl isocyanate Journal of Molecular Structure. 324: 93-105. DOI: 10.1016/0022-2860(94)08229-4 |
0.641 |
|
| 1994 |
Chatterjee KK, Durig JR. Microwave spectrum and structure of trimethylphosphine selenide Journal of Molecular Structure. 327: 237-240. DOI: 10.1016/0022-2860(94)08164-6 |
0.516 |
|
| 1994 |
Durig JR, Tang Q, Phan HV. Conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment of methyl propargyl ether Journal of Molecular Structure. 320: 193-216. DOI: 10.1016/0022-2860(93)08014-U |
0.685 |
|
| 1994 |
Durig J, Guirgis G, Mohamed T, Herrebout W, Afifi M. Spectra and structure of silicon-containing compounds. XIX. Raman and infrared spectra, conformational stability, vibrational assignment, barrier to internal rotation, and ab initio calculations of ethyldifluorosilane Journal of Molecular Structure. 319: 109-127. DOI: 10.1016/0022-2860(93)07939-T |
0.707 |
|
| 1994 |
Chatterjee KK, Durig JR. Spectra and structure of organophosphorus compounds: XLIX. Microwave, infrared, and Raman spectra, electric dipole moment, molecular structure, and ab initio calculations of dimethylphosphonothioic fluoride Structural Chemistry. 5: 239-253. DOI: 10.1007/BF02275497 |
0.505 |
|
| 1994 |
Durig JR, Guirgis GA, Drew AS. Raman and infrared spectra, conformational stability, barriers to internal rotation and ab initio calculations of allyl cyanide Journal of Raman Spectroscopy. 25: 907-921. DOI: 10.1002/Jrs.1250251203 |
0.59 |
|
| 1994 |
Durig JR, Daeyaert FFD, van der Veken BJ. Spectra and structure of organophosphorus compounds. L-Raman and infrared spectra, conformational stability, ab initio calculations and vibrational assignment of fluoromethylphosphonic dichloride Journal of Raman Spectroscopy. 25: 869-886. DOI: 10.1002/Jrs.1250251105 |
0.728 |
|
| 1994 |
Durig JR, Eltayeb S, Guirgis GA. Raman and infrared spectra, conformational stability, barriers to internal rotation, vibrational assignment and ab initio calculations of 3-bromo-2-methylpropene Journal of Raman Spectroscopy. 25: 767-780. DOI: 10.1002/Jrs.1250250905 |
0.686 |
|
| 1994 |
Stidham HD, Vlaservich AC, Hsu DY, Guirgis GA, Durig JR. Raman and infrared spectra, conformational stability, barrier to internal rotation, and ab initio calculations for 1,1-dichloromethyl methyl ether Journal of Raman Spectroscopy. 25: 747-760. DOI: 10.1002/Jrs.1250250903 |
0.841 |
|
| 1994 |
Little TS, Vaughn CA, Zhu X, Dakkouri M, Durig JR. Spectra and structure of small-ring compounds. LXII-Raman and infrared spectra, conformational stability, vibrational assignment and ab initio calculations of cyclopropylmethyltrifluorosilane Journal of Raman Spectroscopy. 25: 735-746. DOI: 10.1002/Jrs.1250250902 |
0.715 |
|
| 1994 |
Durig JR, Guirgis GA, Krutules KA, Phan H, Stidham HD. Raman and infrared spectra, conformational stability, barriers to internal rotation and ab initio calculations of fluorocarbonyl isocyanate Journal of Raman Spectroscopy. 25: 221-232. DOI: 10.1002/Jrs.1250250306 |
0.85 |
|
| 1994 |
Durig JR, Davis JF, Guirgis GA. Raman and far infrared spectra, structural parameters, and ab initio calculations on acetyl chloride Journal of Raman Spectroscopy. 25: 189-198. DOI: 10.1002/jrs.1250250208 |
0.519 |
|
| 1994 |
Afifi MS, Guirgis GA, Mohamed TA, Herrebout WA, Durig JR. Spectra and structure of silicon-containing compounds. XVIII-Raman and infrared spectra, conformational stability, vibrational assignment, barrier to internal rotation and ab initio calculations of ethyldichlorosilane Journal of Raman Spectroscopy. 25: 159-174. DOI: 10.1002/Jrs.1250250205 |
0.718 |
|
| 1994 |
Durig JR, Zhao W. Calculation of the reduced mass of some four-membered rings as a function of ring-puckering coordinate based on optimized ab initio structural parameters Journal of Physical Chemistry. 98: 9202-9206. |
0.308 |
|
| 1993 |
Durig J, Costner T, Little T. Raman and infrared spectra, conformational stability, vibrational assignment, and ab initio calculations of cis-1,3-dichloropropene Canadian Journal of Chemistry. 71: 1751-1763. DOI: 10.1139/v93-218 |
0.617 |
|
| 1993 |
Qtaitat M, Durig J. Spectra and structure of silicon-containing compounds—XVI. Infrared and Raman spectra, conformational stability, ab initio calculations, r0 structure and vibrational assignment for ethyl chlorosilane Spectrochimica Acta Part a: Molecular Spectroscopy. 49: 2139-2157. DOI: 10.1016/S0584-8539(09)91022-4 |
0.553 |
|
| 1993 |
Stampf E, Odom J, Kim YH, Garber A, Wasacz F, Durig J. Infrared, Raman and NMR spectra, conformational stability, and ab initio calculations of divinylmethoxyborane Spectrochimica Acta Part a: Molecular Spectroscopy. 49: 2117-2137. DOI: 10.1016/S0584-8539(09)91021-2 |
0.563 |
|
| 1993 |
Galabov B, Ilieva S, Dudev T, Phan H, Durig J. Interpretation and prediction of vibrational absorption intensities: methylethyl ether and diethyl ether Spectrochimica Acta Part a: Molecular Spectroscopy. 49: 2093-2103. DOI: 10.1016/S0584-8539(09)91019-4 |
0.356 |
|
| 1993 |
Nanaie H, Guirgis G, Durig J. Torsional spectra of molecules with two C3v rotors—XXV. Rotational and vibrational spectra, r0 structure, barriers to internal rotation and ab initio calculations for 2,2-difluoropropane Spectrochimica Acta Part a: Molecular Spectroscopy. 49: 2039-2056. DOI: 10.1016/S0584-8539(09)91014-5 |
0.522 |
|
| 1993 |
Keresztury G, Holly S, Besenyei G, Varga J, Wang A, Durig J. Vibrational spectra of monothiocarbamates-II. IR and Raman spectra, vibrational assignment, conformational analysis and ab initio calculations of S-methyl-N,N-dimethylthiocarbamate Spectrochimica Acta Part a: Molecular Spectroscopy. 49: 2007-2026. DOI: 10.1016/S0584-8539(09)91012-1 |
0.482 |
|
| 1993 |
Phan H, Guirgis G, Durig J. Infrared and raman spectra, conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment of difluoroacetyl chloride Spectrochimica Acta Part a: Molecular Spectroscopy. 49: 1967-1986. DOI: 10.1016/S0584-8539(09)91009-1 |
0.584 |
|
| 1993 |
Guirgis G, van der Veken B, Liu J, Durig J. Far-IR spectra, barriers to internal rotation, r0 structural parameters and ab initio calculations of chloromethyl methyl ether Spectrochimica Acta Part a: Molecular Spectroscopy. 49: 1947-1965. DOI: 10.1016/S0584-8539(09)91008-X |
0.468 |
|
| 1993 |
Sullivan J, Wang A, Durig J, Godbey S. Microwave, infrared and Raman spectra, conformational stability, barriers to internal rotation, vibrational assignment, and ab initio calculations for 1-fluoro-2-methylpropane Spectrochimica Acta Part a: Molecular Spectroscopy. 49: 1889-1911. DOI: 10.1016/S0584-8539(09)91005-4 |
0.586 |
|
| 1993 |
van der Veken B, Sanders R, Harlan R, Durig J. Spectra and structure of phosphorus-boron compounds—XXVII. Low-resolution microwave, IR and Raman spectra, conformational stability, ab initio calculations, vibrational assignment and normal coordinate calculations for (chloromethyl)difluorophosphine borane Spectrochimica Acta Part a: Molecular Spectroscopy. 49: 1833-1871. DOI: 10.1016/S0584-8539(09)91003-0 |
0.583 |
|
| 1993 |
Durig J, Costner T, Wang A, Frierson G, Durig D. Raman and infrared spectra, conformational stability, barriers to internal rotation, vibrational assignment and ab initio calculations of trans-1-chloro-2-butene Journal of Molecular Structure. 300: 257-279. DOI: 10.1016/0022-2860(93)87023-3 |
0.593 |
|
| 1993 |
Durig JR, Wang A. Ab initio calculations in vibrational spectroscopy Journal of Molecular Structure. 294: 13-16. DOI: 10.1016/0022-2860(93)80303-D |
0.524 |
|
| 1993 |
Davis J, Wang A, Durig J. Combination of Raman data and ab initio calculations for the determination of the conformational stability of the Oxalyl halides Journal of Molecular Structure. 293: 27-30. DOI: 10.1016/0022-2860(93)80008-J |
0.502 |
|
| 1993 |
Krutules K, Sullivan J, Guirgis G, Phan H, Durig J. Raman and infrared spectra and ab initio calculations for the determination of the conformational stability for fluorocarbonyl and acetyl isocyanate Journal of Molecular Structure. 293: 23-26. DOI: 10.1016/0022-2860(93)80007-I |
0.561 |
|
| 1993 |
Durig D, Little T, Costner T, Guirgis G, Durig J. Raman and far infrared spectra and conformational analysis of some dichloropropenes Journal of Molecular Structure. 293: 19-22. DOI: 10.1016/0022-2860(93)80006-H |
0.483 |
|
| 1993 |
Durig J, Little T, Zhu X, Dakkouri M. Vibrational spectra and assignments, conformational stability, and ab initio calculations of cyclopropylmethyl silanes Journal of Molecular Structure. 293: 15-18. DOI: 10.1016/0022-2860(93)80005-G |
0.589 |
|
| 1993 |
Guirgis G, Phan H, Davis J, Durig J. Vibrational spectra, conformational stabilities, and barriers to internal rotation of the difluoroacetyl halides Journal of Molecular Structure. 293: 11-14. DOI: 10.1016/0022-2860(93)80004-F |
0.49 |
|
| 1993 |
van der Veken BJ, Lin J, Durig JR. Raman and infrared spectra, conformational stability, barriers to internal rotation,r 0 structural parameters, ab initio calculations, and vibrational assignment for vinyl chloroformate Structural Chemistry. 4: 167-181. DOI: 10.1007/Bf00679343 |
0.699 |
|
| 1993 |
Durig JR, Liu J, Guirgis GA, van der Veken BJ. Vibrational spectra, conformational stability, barriers to internal rotation, r0 structural parameters and ab initio calculations of fluoromethyl methyl ether Structural Chemistry. 4: 103-126. DOI: 10.1007/BF00677371 |
0.537 |
|
| 1993 |
Durig JR, Tang Q, Phan HV. Raman and infrared spectra, conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment of cyanomethyl methyl ether Journal of Raman Spectroscopy. 24: 851-865. DOI: 10.1002/Jrs.1250241206 |
0.702 |
|
| 1993 |
Stampf EJ, Kim YH, Durig JR. Raman, infrared and NMR spectra, conformational stability and ab initio calculations of trimethoxyborane Journal of Raman Spectroscopy. 24: 725-735. DOI: 10.1002/jrs.1250241103 |
0.552 |
|
| 1993 |
Durig JR, Costner TG, Goodson B. Raman and infrared spectra, conformational stability, barriers to internal rotation, vibrational assignment and ab initio calculations of trans-1-bromobut-2-ene Journal of Raman Spectroscopy. 24: 709-724. DOI: 10.1002/jrs.1250241102 |
0.599 |
|
| 1993 |
Durig JR, Tang Q, Little TS. Conformational stability, barriers to internal rotation, vibrational assignments and Ab Initio calculations of 3-methylbut-1-ene Journal of Raman Spectroscopy. 24: 555-572. DOI: 10.1002/jrs.1250240902 |
0.534 |
|
| 1993 |
Durig JR, Groner CU, Costner TG, Wang A. Raman and infrared spectra, conformational stability, vibrational assignment, barriers to internal rotation and ab initio calculations of but-2-enoyl chloride Journal of Raman Spectroscopy. 24: 335-350. DOI: 10.1002/jrs.1250240602 |
0.593 |
|
| 1993 |
Durig DT, Guirgis GA, Zhen M, Durig JR. Raman and far‐infrared spectra, conformational stability, barriers to internal rotation, vibrational assignment and ab initio calculations of 2‐bromo‐3‐fluoropropene Journal of Raman Spectroscopy. 24: 287-298. DOI: 10.1002/jrs.1250240505 |
0.578 |
|
| 1993 |
Durig JR, Guirgis GA, Krutules KA, Sullivan JF. Raman and infrared spectra, conformational stability, barriers to internal rotation and ab initio calculations of acetyl isocyanate Journal of Raman Spectroscopy. 24: 259-273. DOI: 10.1002/jrs.1250240502 |
0.559 |
|
| 1993 |
Baranović G, Eckert-Maksić M, Golić M, Durig JR. Vibrational spectra, ab initio calculations and normal coordinate analysis for 3-methyl-3-vinylcyclopropene Journal of Raman Spectroscopy. 24: 31-41. DOI: 10.1002/jrs.1250240105 |
0.486 |
|
| 1993 |
Mohamed TA, Stidham HD, Guirgis GA, Phan HV, Durig JR. Raman and infrared spectra, conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment for bromodifluoroacetyl chloride Journal of Raman Spectroscopy. 24: 1-10. DOI: 10.1002/Jrs.1250240102 |
0.83 |
|
| 1993 |
Durig DT, Litile TS, Durig JR. Far-IR spectrum, conformation stability, barriers to internal rotation, vibrational assignment, and Db initio calculations of 3-chloro-2-methylpropene Spectrochimica Acta - Part a Molecular Spectroscopy. 49: 1873-1888. |
0.587 |
|
| 1993 |
Durig JR, Nanaie H, DesMarteau DD. Microwave spectrum, quadrupole coupling constants, structure and ab initio calculations of N-bromocyanofluoromethanimine The Journal of Chemical Physics. 99: 4340-4345. |
0.421 |
|
| 1992 |
Durig JR, Groner P, Lin J, van der Veken BJ. Structure of methyl cyanoformate from microwave spectroscopy and ab initio calculations The Journal of Chemical Physics. 96: 8062-8071. DOI: 10.1063/1.462358 |
0.382 |
|
| 1992 |
Durig JR, Liu J, Little TS, Kalasinsky VF. Conformational analysis, barriers to internal rotation, vibrational assignment, and ab initio calculations of 1,2-difluoroethane The Journal of Physical Chemistry. 96: 8224-8233. DOI: 10.1021/J100200A006 |
0.635 |
|
| 1992 |
Durig JR, Guirgis GA, Brewer WE, Baranovic G. Microwave, infrared, and Raman spectra, conformational stability, structural parameters, vibrational assignment, and ab initio calculations for 2-methylpropionyl fluoride The Journal of Physical Chemistry. 96: 7547-7554. DOI: 10.1021/j100198a013 |
0.583 |
|
| 1992 |
Durig JR, Hizer TJ, Harlan RJ. Spectra and structure of organophosphorus compounds. 44. Conformational stability, barriers to internal rotation, vibrational assignment, and ab initio calculations for ethylphosphonic difluoride The Journal of Physical Chemistry. 96: 541-548. DOI: 10.1021/j100181a010 |
0.549 |
|
| 1992 |
Georgieva G, Dudev T, Galabov B, Durig J. Vibrational intensity analysis of 1,2-dichloroethane and 1-chloropropane Vibrational Spectroscopy. 3: 9-21. DOI: 10.1016/0924-2031(92)85020-2 |
0.338 |
|
| 1992 |
Durig J, Min JL, Little T, Dakkouri M, Grünvogel-Hurst A. Spectra and structure of small ring compounds—LX. Raman and infrared spectra, conformational stability, normal coordinate analysis, and ab initio calculations of cyclobutyl acetylene Spectrochimica Acta Part a: Molecular Spectroscopy. 48: 691-714. DOI: 10.1016/0584-8539(92)80214-H |
0.56 |
|
| 1992 |
Durig JR, Daeyaert FFD. Ab initio calculation of the structural parameters, conformational stability, vibrational frequencies and Raman and infrared intensities of methoxydimethylphosphine Journal of Molecular Structure: Theochem. 261: 133-152. DOI: 10.1016/0166-1280(92)87072-8 |
0.571 |
|
| 1992 |
Durig J, Barron D, Sullivan J, Anderson D, Cradock S, Rankin D. Conformational stability and molecular structure of dimethyl (methylthio) phosphine from electron diffraction studies and ab initio calculations Journal of Molecular Structure. 268: 143-154. DOI: 10.1016/0022-2860(92)85068-R |
0.507 |
|
| 1992 |
Durig J, Wang A, Little T. Conformational stability, barrier to internal rotation, structural parameters, ab initio calculations, and vibrational assignment of cyclopropylcarbonyl chloride Journal of Molecular Structure. 269: 285-308. DOI: 10.1016/0022-2860(92)85003-Y |
0.53 |
|
| 1992 |
Durig J, Tang Q, Little T. Low frequency vibrational spectra, barrier to internal rotation, and RHF/STO-3G* ab initio calculations of 3-bromopropene Journal of Molecular Structure. 269: 257-283. DOI: 10.1016/0022-2860(92)85002-X |
0.501 |
|
| 1992 |
Chatterjee K, Durig J, Bell S. Microwave spectrum, r0 structure, and ab initio calculations for trimethylphosphine Journal of Molecular Structure. 265: 25-45. DOI: 10.1016/0022-2860(92)80236-B |
0.392 |
|
| 1992 |
Durig DT, Little TS, Costner TG, Durig JR. Conformational stability and structural parameters of 3-fluoropropene and some substituted derivatives Journal of Molecular Structure. 266: 277-282. DOI: 10.1016/0022-2860(92)80079-W |
0.542 |
|
| 1992 |
Sullivan J, Nandy S, Joo Lee M, Durig J. FT-Raman spectrum and conformational stability of liquid chlorocarbonyl isocyanate Journal of Molecular Structure. 266: 271-276. DOI: 10.1016/0022-2860(92)80078-V |
0.412 |
|
| 1992 |
Guirgis GA, Phan HV, Durig JR. Raman spectra and conformational stability of 2-methylpropionyl chloride Journal of Molecular Structure. 266: 265-270. DOI: 10.1016/0022-2860(92)80077-U |
0.596 |
|
| 1992 |
Durig J, Joo Lee M, Badawi H, Sullivan J, Durig D. Some applications of ab initio calculations in molecular spectroscopy Journal of Molecular Structure. 266: 59-64. DOI: 10.1016/0022-2860(92)80050-R |
0.377 |
|
| 1992 |
van der Veken B, Coppens P, Sanders R, Daeyaert F, Durig J. Spectra and structure of organophosphorus compounds XLV. Vibrational spectra, conformational stability, ab initio calculations, and vibrational assignment of chloromethyl difluorophosphine and chloromethyl difluorophosphine-d2 Journal of Molecular Structure. 272: 305-346. DOI: 10.1016/0022-2860(92)80038-J |
0.559 |
|
| 1992 |
Durig DT, Guirgis GA, Durig JR. Far infrared spectrum, conformational stability, barriers to internal rotation, vibrational assignment, and ab initio calculations of 2-chloro-3-fluoropropene Structural Chemistry. 3: 347-361. DOI: 10.1007/BF00678558 |
0.559 |
|
| 1992 |
Durig JR, Tang Q, Little TS. Raman and infrared spectra, conformational stability, barriers to internal rotation, vibrational assignment, and ab initio calculations for 3-iodopropene Journal of Raman Spectroscopy. 23: 653-666. DOI: 10.1002/jrs.1250231202 |
0.583 |
|
| 1992 |
Durig JR, Bergana MM, Zunic WM. Fourier transform Raman spectrum of polycrystalline pyrazole, vibrational assignment and ab initio calculations Journal of Raman Spectroscopy. 23: 357-363. DOI: 10.1002/jrs.1250230607 |
0.478 |
|
| 1992 |
Durig JR, Lin J, van der Veken BJ. Raman and infrared spectra, conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment for vinyl fluoroformate Journal of Raman Spectroscopy. 23: 287-298. DOI: 10.1002/jrs.1250230508 |
0.585 |
|
| 1992 |
Durig JR, Lin J, Phan HV. Raman and infrared spectra, conformational stability, barriers to internal rotation, vibrational assignment and ab initio calculation of bromoacetone Journal of Raman Spectroscopy. 23: 253-266. DOI: 10.1002/jrs.1250230504 |
0.679 |
|
| 1992 |
van der Veken BJ, Guirgis GA, Liu J, Durig JR. Vibrational spectrum, conformational stability, barriers to internal rotation, r0 structural parameters and ab initio calculations of bromomethyl methyl ether Journal of Raman Spectroscopy. 23: 205-223. DOI: 10.1002/jrs.1250230405 |
0.514 |
|
| 1992 |
Durig JR, Smith DF, Barron DA, Harlan RJ, Phan HV. Spectra and structure of organophosphorus compounds. XLVIII—Raman and infrared spectra, conformational stability, vibrational assignments and ab initio calculations of dimethyl(methylthio)phosphine Journal of Raman Spectroscopy. 23: 107-124. DOI: 10.1002/jrs.1250230208 |
0.619 |
|
| 1992 |
Sullivan JF, Nandy SK, Lee MJ, Durig JR. Raman and infrared spectra, conformational stability and ab initio calculations for chlorocarbonyl isocyanate Journal of Raman Spectroscopy. 23: 51-60. DOI: 10.1002/jrs.1250230107 |
0.561 |
|
| 1992 |
Durig JR, Costner TG, Little TS, Durig DT. Infrared and Raman spectra, conformational analysis, barriers to internal rotation, vibrational assignment, and ab initio calculations of trans-1,3-dichloropropene Journal of Physical Chemistry. 96: 7194-7202. |
0.607 |
|
| 1991 |
Sullivan JF, Wang A, Cheng M, Durig JR. The vibrational spectrum, barrier to internal rotation, and ab initio calculations of 2-chloropropane Canadian Journal of Chemistry. 69: 1845-1856. DOI: 10.1139/v91-268 |
0.557 |
|
| 1991 |
Durig JR, Feng FS, Wang A, Phan HV. Conformational stability, barriers to internal rotation, ab initio calculations, and vibrational assignment of 2-butanone Canadian Journal of Chemistry. 69: 1827-1844. DOI: 10.1139/v91-267 |
0.623 |
|
| 1991 |
Groner P, Lee MJ, Durig JR. The microwave spectrum of the equatorial conformer of chlorocyclopentane The Journal of Chemical Physics. 94: 3315-3321. DOI: 10.1063/1.459754 |
0.413 |
|
| 1991 |
Durig JR, Liu J, Little TS. Conformational analysis, barriers to internal rotation, ab initio calculations and vibrational assignment of 1-chloro-2-fluoroethane The Journal of Physical Chemistry. 95: 4664-4672. DOI: 10.1021/j100165a015 |
0.547 |
|
| 1991 |
Durig JR, Wang AY, Little TS, Brletic PA. Conformational stability, barriers to internal rotation, vibrational assignment, and RHF/STO-3G* calculations of 2-bromopropenoyl fluoride The Journal of Physical Chemistry. 95: 3569-3578. DOI: 10.1021/j100162a026 |
0.518 |
|
| 1991 |
Durig JR, Qiu HZ, Durig DT, Zhen M, Little TS. Microwave, infrared, and Raman spectra, conformational stability, barriers to internal rotation, ab initio calculations, and vibrational assignment of 3-fluoro-2-methylpropene The Journal of Physical Chemistry. 95: 2745-2757. DOI: 10.1021/j100160a024 |
0.586 |
|
| 1991 |
Durig JR, McArver AQ, Phan HV, Guirgis GA. Far-infrared spectrum, conformational stability, barriers to internal rotation, ab initio calculations, and vibrational assignment of propionyl chloride The Journal of Physical Chemistry. 95: 539-550. DOI: 10.1021/j100155a011 |
0.566 |
|
| 1991 |
Durig J, Lin J, Tolley C, Little T. Conformational analysis, barriers to internal rotation, vibrational assignment and ab initio calculations of chloroacetone Spectrochimica Acta Part a: Molecular Spectroscopy. 47: 105-123. DOI: 10.1016/0584-8539(91)80183-J |
0.544 |
|
| 1991 |
Durig JR, Mamula Bergana M, Phan HV. Conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment of dichloroacetyl chloride Journal of Molecular Structure. 242: 179-205. DOI: 10.1016/0022-2860(91)87135-5 |
0.666 |
|
| 1991 |
Durig JR, Kenton R, Phan HV, Little TS. Far-infrared spectra and barriers to internal rotation of pivaldehyde, pivaloyl fluoride, pivaloyl chloride and pinacolone Journal of Molecular Structure. 247: 237-251. DOI: 10.1016/0022-2860(91)87076-T |
0.417 |
|
| 1991 |
Durig J, Sheehan T, Hardin J. Conformational stability, barriers to internal rotation, and vibrational assignment of 1-bromo-3,3,3-trifluoro-2-propanone Journal of Molecular Structure. 243: 275-295. DOI: 10.1016/0022-2860(91)87044-I |
0.444 |
|
| 1991 |
Durig J, Sullivan J, Qtaitat M. Infrared and raman spectra, conformational stability, barriers to internal rotation, ab initio calculations, ro structure, and vibrational assignment for methyl vinyl silane Journal of Molecular Structure. 243: 239-273. DOI: 10.1016/0022-2860(91)87043-H |
0.569 |
|
| 1991 |
Durig J, Guirgis G, Brewer W, Little T. Vibrational spectra and structure, ab initio calculations, and conformational stability of 2-methylpropanal Journal of Molecular Structure. 248: 49-77. DOI: 10.1016/0022-2860(91)85003-L |
0.566 |
|
| 1991 |
Durig J, Liu J, Little T. Conformational stability, far-infrared spectra, barriers to internal rotation, vibrational assignment and RHF/STO - 3G* calculations of 1 -bromo- 2 -fluoroethane Journal of Molecular Structure. 248: 25-48. DOI: 10.1016/0022-2860(91)85002-K |
0.585 |
|
| 1991 |
Durig JR, Guirgis GA, Phan HV. Far-infrared spectrum, conformational stability, barriers to internal rotation, ab initio calculations, and vibrational assignment of propionyl bromide Journal of Molecular Structure. 244: 139-164. DOI: 10.1016/0022-2860(91)80153-U |
0.579 |
|
| 1991 |
Durig JR, Wang AY, Little TS. Far-infrared spectrum, barriers to internal rotation, structural parameters, and vibrational assignment of cyclopropylcarbonyl fluoride Journal of Molecular Structure. 244: 117-137. DOI: 10.1016/0022-2860(91)80152-T |
0.561 |
|
| 1991 |
Durig JR, Geyer TJ, Hae Kim Y, Kalasinsky VF, McDonald JK. Far-infrared spectra and ab initio calculations of nitrosyl chloride Journal of Molecular Structure. 244: 103-115. DOI: 10.1016/0022-2860(91)80151-S |
0.516 |
|
| 1991 |
Durig JR, Rollins MS, Phan HV. Conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment of ethyl methyl sulfide Journal of Molecular Structure. 263: 95-122. DOI: 10.1016/0022-2860(91)80059-D |
0.564 |
|
| 1991 |
Durig JR, Wang A, Beshir W, Little TS. Barrier to asymmetric internal rotation, conformational stability, vibrational spectra and assignments, and Ab Initio calculations of n-butane-d0, d5 and d10 Journal of Raman Spectroscopy. 22: 683-704. DOI: 10.1002/jrs.1250221115 |
0.438 |
|
| 1991 |
Durig JR, Nanaie H, Guirgis GA. Raman and infrared spectra, barriers to internal rotation, vibrational assignments and ab initio calculations on 2-fluoropropane Journal of Raman Spectroscopy. 22: 155-168. DOI: 10.1002/jrs.1250220305 |
0.552 |
|
| 1991 |
Durig JR, Bergana MM, Phan HV. Raman and infrared spectra, conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment of dichloroacetyl fluoride Journal of Raman Spectroscopy. 22: 141-154. DOI: 10.1002/jrs.1250220304 |
0.61 |
|
| 1991 |
Volovšek V, Baranović G, Colombo L, Durig JR. Vibrational spectra of para-disubstituted benzophenones Journal of Raman Spectroscopy. 22: 35-41. DOI: 10.1002/jrs.1250220106 |
0.446 |
|
| 1990 |
Guirgis GA, Nanaie H, Durig JR. Microwave and far infrared spectra, r0 structure, barriers to internal rotation, and ab initio calculations for 2‐fluoropropane The Journal of Chemical Physics. 93: 3837-3843. DOI: 10.1063/1.459673 |
0.488 |
|
| 1990 |
Durig JR, Wang AY, Little TS, Brletic PA. Conformational stability, barriers to internal rotation, vibrational assignment, and ab initio calculations of 2‐chloropropenoyl fluoride The Journal of Chemical Physics. 93: 905-917. DOI: 10.1063/1.459117 |
0.607 |
|
| 1990 |
Van der Veken BJ, Maas R, Guirgis GA, Stidham HD, Sheehan TG, Durig JR. Infrared spectrum, ab initio calculations, barriers to internal rotation and structural parameters for methyl nitrite The Journal of Physical Chemistry. 94: 4029-4039. DOI: 10.1021/j100373a028 |
0.737 |
|
| 1990 |
Durig J, Whang C, Harlan R. Spectra and structure of organophosphorus compounds XLVII. Infrared spectrum and normal coordinate calculations of ethylphosphine Vibrational Spectroscopy. 1: 19-28. DOI: 10.1016/0924-2031(90)80003-M |
0.42 |
|
| 1990 |
Durig JR, Lindsay NE. Far-infrared spectra and barriers to internal rotation of ethyl nitrate Spectrochimica Acta Part a: Molecular Spectroscopy. 46: 1125-1135. DOI: 10.1016/0584-8539(90)80230-V |
0.513 |
|
| 1990 |
Durig JR, Badawi HM. Spectra and structure of small ring molecules. XLV. Microwave, infrared, and Raman spectra, conformational stability, dipole moment and vibrational assignment of cyclobutylcarboxaldehyde Chemical Physics. 148: 193-207. DOI: 10.1016/0301-0104(90)89017-K |
0.546 |
|
| 1990 |
Groner P, Tolley CL, Durig JR. A microwave and ab initio structure determination of methyl chloroformate Chemical Physics. 142: 381-394. DOI: 10.1016/0301-0104(90)80033-T |
0.562 |
|
| 1990 |
Phan HV, Durig JR. Conformational stability, structural parameters, and vibrational frequencies from ab initio calculations on fluoroacetaldehyde Journal of Molecular Structure: Theochem. 209: 333-347. DOI: 10.1016/0166-1280(90)80086-4 |
0.493 |
|
| 1990 |
Durig J, Hardin J, Tolley C. Conformational analysis, barriers to internal rotation, ab initio calculations and vibrational assignment for 1,1-dichloroacetone Journal of Molecular Structure. 224: 323-343. DOI: 10.1016/0022-2860(90)87027-U |
0.544 |
|
| 1990 |
Durig JR, Larsen RA. Torsional vibrations and barriers to internal rotation for ethanol and 2,2,2-trifluoroethanol Journal of Molecular Structure. 238: 195-222. DOI: 10.1016/0022-2860(90)85015-B |
0.543 |
|
| 1990 |
Bell S, Guirgis G, Lin J, Durig J. Far infrared spectrum, barrier to internal rotation, r0 structure, and ab initio calculations for acetyl cyanide Journal of Molecular Structure. 238: 183-194. DOI: 10.1016/0022-2860(90)85014-A |
0.449 |
|
| 1990 |
Odom JD, Boccanfuso AM, Mamula Bergana M, Little TS, Durig JR. Infrared and Raman spectra, conformational stability, vibrational assignment and normal coordinate analysis of methyltrifluoromethyldiselenide and bis(trifluoromethyl)diselenide Journal of Molecular Structure. 238: 159-182. DOI: 10.1016/0022-2860(90)85013-9 |
0.574 |
|
| 1990 |
Groner P, Tolley CL, Durig JR. The structure of methyl fluoroformate from microwave spectroscopy and AB initio calculations Journal of Molecular Structure. 223: 471-480. DOI: 10.1016/0022-2860(90)80487-5 |
0.523 |
|
| 1990 |
Durig J, Brletic P, Li Y, Wang A, Little T. Rotational and vibrational spectra, conformational stability, potential functions and ab initio calculations of methacryloyl chloride Journal of Molecular Structure. 223: 291-323. DOI: 10.1016/0022-2860(90)80475-Y |
0.553 |
|
| 1990 |
Stampf EJ, Odom JD, Saari SV, Kim YH, Mamula Bergana M, Durig JR. Dimethylmethoxyborane: vibrational assignment, conformational stability, ab initio calculations and barriers to internal rotation Journal of Molecular Structure. 239: 113-137. DOI: 10.1016/0022-2860(90)80206-Y |
0.631 |
|
| 1990 |
Durig JR, Phan HV. Conformational stability, barriers to internal rotation, normal coordinate analysis, and vibrational assignment of chloroacetyl bromide Structural Chemistry. 1: 61-72. DOI: 10.1007/BF00675785 |
0.532 |
|
| 1990 |
Durig JR, Bergana MM. Infrared and raman spectra, vibrational assignments, normal coordinate analysis, and ab initio calculations of methyltrifluoromethyldisulfide and bis(trifluoromethyl)disulfide Structural Chemistry. 1: 561-577. DOI: 10.1007/BF00674132 |
0.616 |
|
| 1990 |
Durig JR, Sheehan TG. Infrared spectra, vibrational assignment and ab initio calculations for 2,2,2-trifluoroethanimidamide Structural Chemistry. 1: 473-480. DOI: 10.1007/BF00671234 |
0.54 |
|
| 1990 |
Durig JR, Sheehan TG. Raman spectra, vibrational assignment, structural parameters and ab initio calculations for ethyl nitrat Journal of Raman Spectroscopy. 21: 635-644. DOI: 10.1002/jrs.1250211003 |
0.538 |
|
| 1990 |
Stidham HD, Guirgis GA, van der Veken BJ, Sheehan TG, Durig JR. Raman spectra and ab initio calculations for methyl nitrite and methyl-d3 nitrite Journal of Raman Spectroscopy. 21: 615-628. DOI: 10.1002/Jrs.1250210914 |
0.815 |
|
| 1990 |
Little TS, Qtaitat M, Durig JR, Dakkouri M, Dakkouri A. Spectra and structure of small ring compounds. Part LVII-Raman and infrared spectra, vibrational assignment and ab initio calculations of cyclopropyltrifluorosilane Journal of Raman Spectroscopy. 21: 591-600. DOI: 10.1002/jrs.1250210911 |
0.529 |
|
| 1990 |
Durig JR, Lee MJ, Little TS. Spectra and structure of small ring compounds. Part LVI-Raman and far-infrared spectra, conformational stability vibrational assignments, normal coordinate analysis and ab initio calculations of chlorocyclobutane Journal of Raman Spectroscopy. 21: 529-542. DOI: 10.1002/jrs.1250210903 |
0.556 |
|
| 1990 |
Durig JR, Guirgis GA, Phan HV. Conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment of propionyl fluoride Journal of Raman Spectroscopy. 21: 359-369. DOI: 10.1002/jrs.1250210607 |
0.527 |
|
| 1990 |
Durig JR, James CG, Hizer TJ. Spectra and structure of organophosphorus compounds XXXVIII-Raman and infrared spectra, vibrational assignment, conformational stability and normal coordinate analysis for ethylphosphonic dichloride Journal of Raman Spectroscopy. 21: 155-164. DOI: 10.1002/jrs.1250210302 |
0.493 |
|
| 1990 |
Durig JR, Larsen RA, Kelley R, Sun F, Li Y. Raman and infrared spectra, conformational stability and vibrational assignment for 1,1,1-trifluoro-2-methoxypropane Journal of Raman Spectroscopy. 21: 109-122. DOI: 10.1002/jrs.1250210208 |
0.519 |
|
| 1990 |
DURIG JR, WANG AY, LITTLE TS, BRLETIC PA. ChemInform Abstract: Conformational Stability, Barriers to Internal Rotation, Vibrational Assignment, and ab initio Calculations of 2-Chloropropenoyl Fluoride Cheminform. 21. DOI: 10.1002/chin.199045051 |
0.546 |
|
| 1990 |
VAN DER VEKEN BJ, MAAS R, GUIRGIS GA, STIDHAM HD, SHEEHAN TG, DURIG JR. ChemInform Abstract: IR Spectrum, ab initio Calculations, Barriers to Internal Rotation, and Structural Parameters for Methyl Nitrite. Cheminform. 21. DOI: 10.1002/chin.199037039 |
0.743 |
|
| 1990 |
DURIG JR, WANG A, LITTLE TS, BRLETIC PA, BUCENELL JR. ChemInform Abstract: Conformational Stability, Barriers to Internal Rotation, Vibrational Assignment and ab initio Calculations of 2-Fluoropropenoyl Fluoride Cheminform. 21. DOI: 10.1002/chin.199020040 |
0.552 |
|
| 1990 |
VAN DER VEKEN BJ, SANDERS RS, DURIG JR. ChemInform Abstract: Spectra and Structure of Organophosphorus Compounds. Part 41. IR and Raman Spectra, Conformational Assignment and Normal Coordinate Calculations for (Chloromethyl)dichlorophosphine and (Chloromethyl)dichlorophosphine-d2. Cheminform. 21. DOI: 10.1002/chin.199019233 |
0.512 |
|
| 1990 |
DURIG JR, LEE MS, HARLAN RJ, LITTLE TS. ChemInform Abstract: Spectra and Structure of Organophosphorus Compounds. Part 43. Far-IR Spectra and ab initio Calculations of Ethylphosphine Cheminform. 21. DOI: 10.1002/chin.199007239 |
0.489 |
|
| 1990 |
DURIG JR, ZHAO W, BERRY RJ, LITTLE TS. ChemInform Abstract: Infrared and Raman Spectra, Vibrational Assignment, and Conformational Stability of Methacryloyl Bromide. Cheminform. 21. DOI: 10.1002/chin.199006046 |
0.528 |
|
| 1990 |
DURIG JR, PHAN HV. ChemInform Abstract: Conformational Stability, Barriers to Internal Rotation, Normal Coordinate Analysis, and Vibrational Assignment of Chloroacetyl Bromide. Cheminform. 21. DOI: 10.1002/chin.199001033 |
0.434 |
|
| 1990 |
Durig JR, Sullivan JF. Vibrational spectroscopy, Fourier transforms and analytical chemistry Trends in Analytical Chemistry. 9: 104-106. |
0.319 |
|
| 1989 |
Durig JR, Guirgis GA, Little TS, Stiefvater OL. Conformational stability and barriers to internal rotation of 2‐methylpropanal by far infrared and microwave spectroscopy The Journal of Chemical Physics. 91: 738-751. DOI: 10.1063/1.457126 |
0.374 |
|
| 1989 |
Groner P, Attia GM, Mohamad AB, Sullivan JF, Li YS, Durig JR. Microwave spectrum, dipole moment, barrier to internal rotation, and molecular structure of germylazide The Journal of Chemical Physics. 91: 1434-1439. DOI: 10.1063/1.457103 |
0.3 |
|
| 1989 |
Durig JR, Phan HV, Hardin JA, Little TS. Conformational stability, barriers to internal rotation, vibrational assignment and ab initio calculations of fluoroacetyl chloride The Journal of Chemical Physics. 90: 6840-6851. DOI: 10.1063/1.456257 |
0.534 |
|
| 1989 |
Durig JR, Little TS, Geyer TJ, Dakkouri M. Spectra and structure of small ring compounds. 54. Infrared and Raman spectra, conformational stability, and vibrational assignment of cyclobutylgermane The Journal of Physical Chemistry. 93: 6296-6303. DOI: 10.1021/j100354a008 |
0.502 |
|
| 1989 |
Durig JR, Cheng MS, Li YS, Groner P, Stanley AE. Spectra and structure of organophosphorus compounds. 40. Microwave, infrared, and Raman spectra, dipole moments, r0 structure, conformational stability, and vibrational assignment of isopropyldifluorophosphine The Journal of Physical Chemistry. 93: 3492-3503. DOI: 10.1021/j100346a027 |
0.492 |
|
| 1989 |
Durig JR, Guirgis GA, Bell S. Torsional spectrum and ab initio calculations for propene The Journal of Physical Chemistry. 93: 3487-3491. DOI: 10.1021/j100346a026 |
0.478 |
|
| 1989 |
Durig JR, Harlan RJ, Groner P. Microwave, infrared, and Raman spectra, structure, and vibrational assignment of (dimethylamino)difluorophosphine The Journal of Physical Chemistry. 93: 3041-3050. DOI: 10.1021/j100345a035 |
0.467 |
|
| 1989 |
Durig JR, Hardin JA, Phan HV, Little TS. Conformational analysis, barriers to internal rotation, ab initio calculations and vibrational assignment of fluoroacetone Spectrochimica Acta Part a: Molecular Spectroscopy. 45: 1239-1255. DOI: 10.1016/0584-8539(89)80236-3 |
0.604 |
|
| 1989 |
Little T, Qiu J, Durig J. Asymmetric torsional potential function and conformational analysis of furfural by far infrared and Raman spectroscopy Spectrochimica Acta Part a: Molecular Spectroscopy. 45: 789-794. DOI: 10.1016/0584-8539(89)80215-6 |
0.43 |
|
| 1989 |
Durig J, Little T, Tolley C. Raman and infrared spectra, vibrational assignment, barriers to internal rotation and ab initio calculations of methyl fluoroformate and methyl fluoroformate-d3 Spectrochimica Acta Part a: Molecular Spectroscopy. 45: 567-579. DOI: 10.1016/0584-8539(89)80008-X |
0.48 |
|
| 1989 |
Durig JR, Phan HV, Little TS. Conformational stability, barriers to internal rotation and vibrational assignments of fluoroacetyl bromide Chemical Physics. 138: 391-403. DOI: 10.1016/0301-0104(89)87145-9 |
0.495 |
|
| 1989 |
Sullivan J, Qtaitat M, Durig J. Conformational analysis and structural determinations from ab initio calculations for vinyl silyl chloride Journal of Molecular Structure: Theochem. 202: 159-168. DOI: 10.1016/0166-1280(89)87013-7 |
0.462 |
|
| 1989 |
Durig JR, Phan HV, Little TS, Van Der Veken BJ. Conformational analysis and structural determinations from ab initio calculations for chloroacetaldehyde Journal of Molecular Structure: Theochem. 202: 143-157. DOI: 10.1016/0166-1280(89)87012-5 |
0.463 |
|
| 1989 |
Ilieva S, Galabov B, Durig J. Bond polar parameters for dimethyl ether from ab initio mo calculations and experimental infrared intensities Journal of Molecular Structure: Theochem. 200: 543-553. DOI: 10.1016/0166-1280(89)85077-8 |
0.364 |
|
| 1989 |
Durig JR, Godbey SE, Larsen RA. Far-infrared spectra and conformational stability of the epihalohydrins Journal of Molecular Structure. 197: 143-158. DOI: 10.1016/0022-2860(89)85158-0 |
0.559 |
|
| 1989 |
Durig JR, Phan HV, Little TS. Conformational stability, barriers to internal rotation, normal coordinate analyses, and vibrational assignments of bromoacetyl halides Journal of Molecular Structure. 212: 187-220. DOI: 10.1016/0022-2860(89)85078-1 |
0.431 |
|
| 1989 |
Durig J, Zhao W, Berry R, Little T. Infrared and raman spectra, vibrational assignment, and conformational stability of methacryloyl bromide Journal of Molecular Structure. 212: 169-186. DOI: 10.1016/0022-2860(89)85077-X |
0.531 |
|
| 1989 |
Durig J, Durig D, Jalilian M, Zhen M, Little T. Conformational analysis from low-frequency vibrational data and ab initio calculations for 3-chloropropene Journal of Molecular Structure. 194: 259-278. DOI: 10.1016/0022-2860(89)80085-7 |
0.464 |
|
| 1989 |
Durig JR, Phan HV, Hardin JA, Berry RJ, Little TS. Conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment of fluoroacetyl fluoride Journal of Molecular Structure. 198: 365-390. DOI: 10.1016/0022-2860(89)80050-X |
0.511 |
|
| 1989 |
Durig JR, Little TS, Lee MJ. Spectra and structure of small ring compounds. Part LV-Conformational stability of bromocyclobutane from Raman and far-infrared spectra of the gas Journal of Raman Spectroscopy. 20: 757-763. DOI: 10.1002/jrs.1250201202 |
0.434 |
|
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