Formation and structure of molecular O:P-F. Mass spectrometry, infrared spectra of the matrix isolated species and ab initio calculations

1986 ◽  
Vol 108 (25) ◽  
pp. 7905-7911 ◽  
Author(s):  
Reinhart. Ahlrichs ◽  
Ralf. Becherer ◽  
Michael. Binnewies ◽  
Horst. Borrmann ◽  
Michael. Lakenbrink ◽  
...  
Keyword(s):  
Mass Spectrometry ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Infrared Spectra ◽  
The Matrix ◽  
Isolated Species

ChemInform Abstract: Formation and Structure of Molecular O=P-F. Mass Spectrometry, IR Spectra of the Matrix Isolated Species, and ab initio Calculations.

ChemInform ◽  
1987 ◽  
Vol 18 (11) ◽  
Author(s):  
R. AHLRICHS ◽  
R. BECHERER ◽  
M. BINNEWIES ◽  
H. BORRMANN ◽  
M. LAKENBRINK ◽  
...  
Keyword(s):  
Mass Spectrometry ◽  
Ir Spectra ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
The Matrix ◽  
Isolated Species

Infrared spectra and ab initio calculations of the matrix isolated (CO2)·(H2SO4) and (CO2)·(SO3) complexes

2002 ◽  
Vol 604 (2-3) ◽  
pp. 147-157 ◽  
Author(s):  
Aharon Givan ◽  
Aharon Loewenschuss ◽  
Claus J. Nielsen
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Infrared Spectra ◽  
The Matrix

Photoionization and dissociation of BF3·((CH3)2O)n mixed aggregates (n=1, 2) studied by mass spectrometry and ab initio calculations

1997 ◽  
Vol 280 (3-4) ◽  
pp. 251-259 ◽  
Author(s):  
S. Ring ◽  
C.G. Eisenhardt ◽  
H. Baumgärtel
Keyword(s):  
Mass Spectrometry ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Mixed Aggregates

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

1992 ◽  
Vol 23 (1) ◽  
pp. 51-60 ◽  
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

Raman and infrared spectra, conformational stability, barriers to internal rotation, vibrational assignment, and ab initio calculations of 3-methyl-3-butenenitrile

2006 ◽  
Vol 786 (1) ◽  
pp. 9-24 ◽  
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

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

1996 ◽  
Vol 385 (1) ◽  
pp. 7-21 ◽  
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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