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Volumn 9, Issue 21, 2007, Pages 4279-4282

Computing reliable energetics for conjugate addition reactions

Author keywords

[No Author keywords available]

Indexed keywords


EID: 35548929060     PISSN: 15237060     EISSN: None     Source Type: Journal    
DOI: 10.1021/ol701872z     Document Type: Article
Times cited : (63)

References (44)
  • 1
    • 34447279649 scopus 로고    scopus 로고
    • For recent contributions, see: a
    • For recent contributions, see: (a) Schreiner, P. R. Angew. Chem., Int. Ed. 2007, 46, 4217.
    • (2007) Angew. Chem., Int. Ed , vol.46 , pp. 4217
    • Schreiner, P.R.1
  • 11
    • 34447557776 scopus 로고    scopus 로고
    • in press, DOI 10.1007/s00214-007-0310-x
    • (c) Zhao, Y.; Truhla, D. G. Theor. Chem. Acc 2007, in press, DOI 10.1007/s00214-007-0310-x.
    • (2007) Theor. Chem. Acc
    • Zhao, Y.1    Truhla, D.G.2
  • 35
    • 35548942837 scopus 로고    scopus 로고
    • Frisch, M. J. et al. Gaussian 03, revision B.05; Gaussian, Inc.: Wallingford, CT, 2004.
    • (a) Frisch, M. J. et al. Gaussian 03, revision B.05; Gaussian, Inc.: Wallingford, CT, 2004.
  • 36
    • 35548941550 scopus 로고    scopus 로고
    • Bylaska, E. J. et al. NWChem, A Computational Chemistry Package for Parallel Computers, version 5.0; Pacific Northwest National Laboratory: Richland, Washington, 2006
    • (b) Bylaska, E. J. et al. NWChem, A Computational Chemistry Package for Parallel Computers, version 5.0; Pacific Northwest National Laboratory: Richland, Washington, 2006.
  • 37
    • 35548956131 scopus 로고    scopus 로고
    • Ahlrichs, R, et al. TURBOMOLE, version 5.9.1; Universität Karlsruhe, 2007. Full references are given in Supporting Information
    • (c) Ahlrichs, R., et al. TURBOMOLE, version 5.9.1; Universität Karlsruhe, 2007. Full references are given in Supporting Information.
  • 38
    • 35548956584 scopus 로고    scopus 로고
    • For further details and references, see Supporting Information
    • For further details and references, see Supporting Information.
  • 41
    • 84962407641 scopus 로고    scopus 로고
    • For a selection of recent mechanistic DFT studies on organocatalytic reactions, see: a
    • For a selection of recent mechanistic DFT studies on organocatalytic reactions, see: (a) Yamanaka, M.; Itoh, J.; Fuchibe, K.; Akiyama, T. J. ' Am. Chem. Soc 2007, 129, 6756.
    • (2007) J. ' Am. Chem. Soc , vol.129 , pp. 6756
    • Yamanaka, M.1    Itoh, J.2    Fuchibe, K.3    Akiyama, T.4


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.