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Volumn 328, Issue 1-2, 2010, Pages 108-113

Trans effects in the Heck reaction - A model study

Author keywords

Density functional calculations; Heck couplings; Homogeneous catalysis; Palladium; Reaction mechanisms

Indexed keywords

DENSITY-FUNCTIONAL CALCULATIONS; ELECTRONIC GROUND; HECK ARYLATION; HECK COUPLING; HECK REACTIONS; HOMOGENEOUS CATALYSIS; MIGRATORY INSERTION; MODEL STUDY; PRODUCT DISTRIBUTIONS; PRODUCT FORMATION; REACTION MECHANISM; TRANS EFFECT;

EID: 77954853563     PISSN: 13811169     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molcata.2010.06.007     Document Type: Article
Times cited : (19)

References (54)
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    • 77954857526 scopus 로고    scopus 로고
    • LLC New York, NY For documentation and current version of the program, see
    • Jaguar 7.0, Schrodinger 2008 LLC New York, NY For documentation and current version of the program, see www.schrodinger.com
    • (2008) Jaguar 7.0, Schrodinger
  • 51
    • 27344448074 scopus 로고
    • LACVP* combines 6-31G* for light elements with the Hay-Wadt ECP and accompanying basis set for Pd P.J. Hay, and W.R. Wadt J. Chem. Phys. 82 1985 299 310
    • (1985) J. Chem. Phys. , vol.82 , pp. 299-310
    • Hay, P.J.1    Wadt, W.R.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.