Theoretical study of formic acid: A new look at the origin of the planar Z conformation and C-O rotational barrier

Chemical Physics

Volumn 344, Issue 3, 2008, Pages 213-220

  Hirao, Hajime ^a  

^a HEBREW UNIVERSITY OF JERUSALEM   (Israel)

Author keywords

Carboxyl group; Carboxylic acids; Energy decomposition; Reactive bond orbital; Rotational isomerism

Indexed keywords

EID: 39949085593     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2008.01.003     Document Type: Article

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