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Volumn 72, Issue 6, 2007, Pages 2201-2207

Nucleophilic substitution at silicon (SN@Si) via a central reaction barrier

Author keywords

[No Author keywords available]

Indexed keywords

COMPLEXATION; POTENTIAL ENERGY SURFACES; REACTION KINETICS; SUBSTITUTION REACTIONS;

EID: 33947247617     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo070076e     Document Type: Article
Times cited : (150)

References (67)
  • 37
  • 43
    • 33947264415 scopus 로고    scopus 로고
    • ADF, version 2005.01; Scientific Computing & Modelling SCM, Amsterdam, The Netherlands
    • (a) ADF, version 2005.01; Scientific Computing & Modelling (SCM): Amsterdam, The Netherlands.
  • 63
    • 33947202370 scopus 로고    scopus 로고
    • 3Cl] moiety is kept frozen to its geometry in the RC, which is already slightly deformed with respect to the equilibrium geometry of isolated chloromethane because of the interaction with the chloride anion.
    • 3Cl] moiety is kept frozen to its geometry in the RC, which is already slightly deformed with respect to the equilibrium geometry of isolated chloromethane because of the interaction with the chloride anion.
  • 64
    • 33947224794 scopus 로고    scopus 로고
    • For the role of steric repulsion in determining equilibrium geometries, see also: (a) Ref 15a.
    • For the role of steric repulsion in determining equilibrium geometries, see also: (a) Ref 15a.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.