Theoretical study on the isomerization behavior between α,β-unsaturated acyl radicals and α-ketenyl radicals

Journal of Organic Chemistry

Volumn 70, Issue 9, 2005, Pages 3610-3617

  Matsubara, Hiroshi ^a   Ryu, Ilhyong ^a   Schiesser, Carl H ^b  

^a Osaka Prefecture University   (Japan)

^b UNIVERSITY OF MELBOURNE   (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

COMPLEXATION; DERIVATIVES; ELECTRONIC STRUCTURE; ENERGY ABSORPTION; ISOMERS; PROBABILITY DENSITY FUNCTION;

ELECTRON CORRELATION; ENERGY BARRIERS; ISOMERIC SPECIES;

ISOMERIZATION;

1 KETENYLETHYL RADICAL; ALPHA KETENYL; ALPHA,BETA UNSATURATED ACYL; KETENE DERIVATIVE; KETENYLMETHYL; RADICAL; UNCLASSIFIED DRUG;

AB INITIO CALCULATION; ARTICLE; CARBONYLATION; CHEMICAL STRUCTURE; CORRELATION ANALYSIS; DENSITY FUNCTIONAL THEORY; ELECTRON; ISOMERIZATION; MOLECULAR WEIGHT; RADICAL REACTION; THEORETICAL STUDY; TRANS ISOMER;

EID: 17744374989     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo047868i     Document Type: Article

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