Structural and energetic properties of the Br−–C2H2 anion complex from rotationally resolved mid-infrared spectra and ab initio calculations

D. A. Wild; P. J. Milley; Z. M. Loh; P. P. Wolynec; P. S. Weiser; E. J. Bieske

doi:10.1063/1.481919

Structural and energetic properties of the Br−–C2H2 anion complex from rotationally resolved mid-infrared spectra and ab initio calculations

The Journal of Chemical Physics ◽

10.1063/1.481919 ◽

2000 ◽

Vol 113 (3) ◽

pp. 1075-1080 ◽

Cited By ~ 15

Author(s):

D. A. Wild ◽

P. J. Milley ◽

Z. M. Loh ◽

P. P. Wolynec ◽

P. S. Weiser ◽

...

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Infrared Spectra ◽

Mid Infrared ◽

Energetic Properties ◽

Anion Complex

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Infrared spectra, relative stability, and ab initio calculations of the methyl-d3 chloride-hydrogen chloride van der Waals complex observed in liquefied argon

The Journal of Physical Chemistry ◽

10.1021/j100143a017 ◽

1993 ◽

Vol 97 (41) ◽

pp. 10622-10629 ◽

Cited By ~ 8

Author(s):

W. A. Herrebout ◽

B. J. van der Veken

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Hydrogen Chloride ◽

Infrared Spectra ◽

Relative Stability ◽

Van Der Waals ◽

Van Der Waals Complex

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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 ◽

10.1002/jrs.1250250205 ◽

1994 ◽

Vol 25 (2) ◽

pp. 159-174 ◽

Cited By ~ 19

Author(s):

M. S. Afifi ◽

Gamil A. Guirgis ◽

Tarek A. Mohamed ◽

W. A. Herrebout ◽

J. R. Durig

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Internal Rotation ◽

Infrared Spectra ◽

Conformational Stability ◽

Vibrational Assignment

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Raman and infrared spectra, conformational stability and ab initio calculations for chlorocarbonyl isocyanate

Journal of Raman Spectroscopy ◽

10.1002/jrs.1250230107 ◽

1992 ◽

Vol 23 (1) ◽

pp. 51-60 ◽

Cited By ~ 36

Author(s):

J. F. Sullivan ◽

S. K. Nandy ◽

Min Joo Lee ◽

J. R. Durig

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Infrared Spectra ◽

Conformational Stability

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Raman and infrared spectra, conformational stability, barriers to internal rotation, ab initio calculations and vibrational assignment for vinyl fluoroformate

Journal of Raman Spectroscopy ◽

10.1002/jrs.1250230508 ◽

1992 ◽

Vol 23 (5) ◽

pp. 287-298 ◽

Cited By ~ 3

Author(s):

J. R. Durig ◽

Jie Lin ◽

B. J. van der Veken

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Internal Rotation ◽

Infrared Spectra ◽

Conformational Stability ◽

Vibrational Assignment ◽

Barriers To Internal Rotation

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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 ◽

10.1016/j.molstruc.2005.10.015 ◽

2006 ◽

Vol 786 (1) ◽

pp. 9-24 ◽

Cited By ~ 7

Author(s):

James R. Durig ◽

Chao Zheng ◽

Gamil A. Guirgis ◽

Huimin Zhen ◽

Andrea S. Drew ◽

...

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Internal Rotation ◽

Infrared Spectra ◽

Conformational Stability ◽

Vibrational Assignment ◽

Barriers To Internal Rotation

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Far infrared spectra, conformational equilibria, vibrational assignments and ab initio calculations of 2-chloroethanol

Journal of Molecular Structure ◽

10.1016/s0022-2860(96)09336-2 ◽

1996 ◽

Vol 385 (1) ◽

pp. 7-21 ◽

Cited By ~ 17

Author(s):

J.R. Durig ◽

Lin Zhou ◽

T.K. Gounev ◽

Peter Klaeboe ◽

Gamil A. Guirgis ◽

...

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Infrared Spectra ◽

Far Infrared ◽

Vibrational Assignments ◽

Conformational Equilibria ◽

Far Infrared Spectra

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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 ◽

10.1016/s1386-1425(02)00263-9 ◽

2003 ◽

Vol 59 (5) ◽

pp. 979-1002 ◽

Cited By ~ 31

Author(s):

James R. Durig ◽

Chunhua Pan ◽

Gamil A. Guirgis

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Infrared Spectra ◽

Conformational Stability ◽

Vibrational Assignment

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Structures and infrared spectra of fluoride–hydrogen sulfide clusters from ab initio calculations: F–-(H2S)n, n= 1–5

Physical Chemistry Chemical Physics ◽

10.1039/b510923j ◽

2005 ◽

Vol 7 (22) ◽

pp. 3793 ◽

Cited By ~ 3

Author(s):

D. A. Wild ◽

T. Lenzer

Keyword(s):

Hydrogen Sulfide ◽

Ab Initio Calculations ◽

Ab Initio ◽

Infrared Spectra ◽

Sulfide Clusters

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Raman and infrared spectra, barriers to internal rotation, vibrational assignments and ab initio calculations on 2-fluoropropane

Journal of Raman Spectroscopy ◽

10.1002/jrs.1250220305 ◽

1991 ◽

Vol 22 (3) ◽

pp. 155-168 ◽

Cited By ~ 7

Author(s):

J. R. Durig ◽

H. Nanaie ◽

G. A. Guirgis

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Internal Rotation ◽

Infrared Spectra ◽

Vibrational Assignments ◽

Barriers To Internal Rotation

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Raman and infrared spectra, conformational stability,ab initio calculations and vibrational assignment of fluoromethyl phosphonothioic dichloride

Journal of Raman Spectroscopy ◽

10.1002/(sici)1097-4555(199803)29:3<191::aid-jrs225>3.0.co;2-s ◽

1998 ◽

Vol 29 (3) ◽

pp. 191-203 ◽

Cited By ~ 5

Author(s):

J. R. Durig ◽

F. F. D. Daeyaert

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Infrared Spectra ◽

Conformational Stability ◽

Vibrational Assignment

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