A comparative study by AM1 and PM3 methods on the structure and reactivity of disubstituted carbanion 1,2,4-triazolium ylides

Journal of Molecular Structure

Volumn 559, Issue 1-3, 2001, Pages 263-271

  Surpateanu, G G ^a   Vergoten, G ^a   Surpateanu, G ^b  

^a CRESIMM Centre De Recherche Et Etudes En Simulations Et Modélisation Moléculaires   (France)

^b UNIVERSITÉ DU LITTORAL CÔTE D OPALE   (France)

Author keywords

1H 1,2,4 triazolo 5,1a isoindoles; AM1 method; PM3 method; Triazolium carbanion disubstituted ylides

Indexed keywords

1,2,4 TRIAZOLO[5,1 A]ISOINDOLE DERIVATIVE; INDOLE DERIVATIVE; TRIAZOLE DERIVATIVE; UNCLASSIFIED DRUG;

ANALYTIC METHOD; ARTICLE; CONFORMATION; CYCLIZATION; INTERMETHOD COMPARISON; REACTION ANALYSIS; STRUCTURE ANALYSIS;

EID: 0035819325     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0022-2860(00)00705-5     Document Type: Article

References (19)