Ab initio study of the ground state and conformational stability of peroxyacetyl nitrate in internal rotation about the peroxide bond

Russian Chemical Bulletin

Volumn 47, Issue 4, 1998, Pages 578-583

  Antonovsky, V L ^a   Bozhenko, K V ^b   Kitaeva, D Kh ^a  

^a SEMENOV INSTITUTE OF CHEMICAL PHYSICS   (Russian Federation)

^b EMANUEL INSTITUTE OF BIOCHEMICAL PHYSICS   (Russian Federation)

Author keywords

Ab initio quantum chemical calculations; Barriers to internal rotation; Conformational analysis; Molecular structures; Peroxyacetyl nitrate

Indexed keywords

EID: 0032397490     PISSN: 10665285     EISSN: None     Source Type: Journal    
DOI: 10.1007/BF02495956     Document Type: Article

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