Ab initio investigations of the C2F4S isomers and of their interconversions

Journal of Fluorine Chemistry

Volumn 124, Issue 1, 2003, Pages 99-104

  Shim, Irene ^a   Vallano Lorenzo, Sandra ^a   Lisbona Martin, Pilar ^a   Senning, Alexander ^a  

^a TECHNICAL UNIVERSITY OF DENMARK   (Denmark)

Author keywords

Ab initio Hartree Fock; Activation energy; Gaussian 3 theory; M ller Plesset second order; Tetrafluorothiirane; Transition state; Trifluoroethenesulfenyl fluoride; Trifluorothioacetyl fluoride

Indexed keywords

ORGANOFLUORINE DERIVATIVE; SULFUR DERIVATIVE;

ARTICLE; CHEMICAL REACTION; CONFORMATIONAL TRANSITION; CONTROLLED STUDY; ISOMERISM; MATHEMATICAL ANALYSIS; MOLECULAR STABILITY; NORMAL DISTRIBUTION;

EID: 0142154028     PISSN: 00221139     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0022-1139(03)00196-9     Document Type: Article

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