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Volumn 69, Issue 13, 2004, Pages 4299-4308

Mechanisms of Staudinger reactions within density functional theory

Author keywords

[No Author keywords available]

Indexed keywords

DISSOCIATION; ELECTRON TRANSITIONS; MOLECULAR STRUCTURE; PROBABILITY DENSITY FUNCTION; REACTION KINETICS; STEREOCHEMISTRY;

EID: 3042698861     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo049702n     Document Type: Article
Times cited : (98)

References (97)
  • 82
    • 0037048318 scopus 로고    scopus 로고
    • Theoretical studies: (a) Moc, J. Chem. Phys. Lett. 2002, 363, 328.
    • (2002) Chem. Phys. Lett. , vol.363 , pp. 328
    • Moc, J.1
  • 97
    • 3042755013 scopus 로고    scopus 로고
    • note
    • α bond distance to that of the trans-transition state in the gas phase (2.11 Å) and did constrained geometry optimization. In this constrained geometry optimization, the trans-structure turned to a cis-conformation in the end.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.