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Volumn 102, Issue 4, 1998, Pages 719-734

Phosphate ester hydrolysis in aqueous solution: Associative versus dissociative mechanisms

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVATION ENERGY; ASSOCIATION REACTIONS; DISSOCIATION; ELECTROSTATICS; ESTERS; FREE ENERGY; MATHEMATICAL MODELS; MOLECULAR STRUCTURE; PHOSPHATES; QUANTUM THEORY; REACTION KINETICS; SOLUTIONS;

EID: 0031646592     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp972182y     Document Type: Article
Times cited : (231)

References (76)
  • 3
    • 84962355850 scopus 로고    scopus 로고
    • note
    • Although the classification of mechanisms as associative or dissociative may partially depend on the definition used (see section 3.3), we clearly can talk about two limiting cases where the nature of the transition state is fundamentally different.
  • 30
    • 84962367344 scopus 로고
    • Lipkowitz, K. B., Boyd, D. B., Ed.; VCH: New York
    • Gao, J. In Reviews in Computational Chemistry; Lipkowitz, K. B., Boyd, D. B., Ed.; VCH: New York, 1995; Vol. 7, p 119.
    • (1995) Reviews in Computational Chemistry , vol.7 , pp. 119
    • Gao, J.1
  • 42
    • 0041561440 scopus 로고    scopus 로고
    • University of Southern California: Los Angeles
    • Florián, J.; Warshel, A. ChemSol; University of Southern California: Los Angeles, 1997.
    • (1997) ChemSol
    • Florián, J.1    Warshel, A.2
  • 75
    • 84962336301 scopus 로고    scopus 로고
    • note
    • Consider, for example, Figure 1 in ref 76, which shows a free energy surface for the nonenzymatic phosphoryl transfer reaction in such a way that the associative pathway has a 2 times higher activation barrier than the dissociative mechanism.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.