Rotational isomerism around the C-O bond in saturated acyclic alcohols - Assignment of the experimental IR hydroxyl stretch bands using semiempirical MO and ab initio calculations

Journal of Molecular Structure

Volumn 407, Issue 1, 1997, Pages 27-38

  Bakke, Jan M ^a   Bjerkeseth, Leif H ^a,b  

^a NORWEGIAN UNIVERSITY OF SCIENCE AND TECHNOLOGY   (Norway)

^b NORWEGIAN DEFENCE RESEARCH ESTABLISHMENT FFI   (Norway)

Author keywords

Ab initio; IR hydroxyl stretch band assignment; IR hydroxyl stretch frequency calculation

Indexed keywords

EID: 0030906185     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0022-2860(96)09726-8     Document Type: Article

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