Far infrared spectrum, ab initio calculations, and conformational analysis of 1-pentyne

Journal of Physical Chemistry A

Volumn 101, Issue 34, 1997, Pages 5987-5996

  Bell, Stephen ^a,c   Guirgis, Gamil A ^b,c   Li, Yin ^c   Durig, James R ^c  

^a UNIVERSITY OF DUNDEE   (United Kingdom)

^b BAYER CORPORATION   (United States)

^c UNIVERSITY OF MISSOURI KANSAS CITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; CONFORMATIONS; ELECTRON ENERGY LEVELS; ELECTRON TRANSITIONS; ENTHALPY; INFRARED SPECTROSCOPY; MOLECULAR DYNAMICS; RAMAN SPECTROSCOPY;

PENTYNE;

HYDROCARBONS;

EID: 0031213457     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp970163i     Document Type: Article

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