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Volumn 126, Issue 24, 2004, Pages 7627-7638

Electronic structure control of the nucleophilicity of transition metal-thiolate complexes: An experimental and theoretical study

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; CRYSTAL STRUCTURE; ELECTRONIC STRUCTURE; REACTION KINETICS; SYNTHESIS (CHEMICAL);

EID: 2942635092     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja039419q     Document Type: Article
Times cited : (60)

References (69)
  • 8
    • 0025877861 scopus 로고
    • (a) Gibbs, J. B. Cell 1991, 65, 1-4.
    • (1991) Cell , vol.65 , pp. 1-4
    • Gibbs, J.B.1
  • 26
    • 2942690180 scopus 로고    scopus 로고
    • unpublished results
    • 2+. In all cases, these complexes are purple and contain high-spin metal centers. Full details of the structures and solution behavior of these compounds will be reported elsewhere. Mitchell, M. H.; Halfen, J. A., unpublished results.
    • Mitchell, M.H.1    Halfen, J.A.2
  • 32
    • 2942657853 scopus 로고    scopus 로고
    • note
    • 2 converged with final R1 = 0.0691 and wR2 = 0.1069 for 4045 reflections with I > 2σ(I) and 442 variable parameters.
  • 42
    • 2942636064 scopus 로고    scopus 로고
    • note
    • x2-y2 orbitals.
  • 51
    • 2942642703 scopus 로고    scopus 로고
    • note
    • Optimized coordinates are provided as Supporting Information.
  • 52
    • 2942673060 scopus 로고    scopus 로고
    • note
    • 2 ligand and its coordination to the M(II) centers is largely unaffected by conversion of the axial ligand from thiolate to thioether. The only significant change is a slight contraction (<0.08 Å) of some of the M(II)-N bonds upon methylation.
  • 54
    • 0003969756 scopus 로고    scopus 로고
    • Molecular Structure Corporation, Inc.: The Woodlands, TX
    • TeXsan for Windows, version 1.02; Molecular Structure Corporation, Inc.: The Woodlands, TX, 1997.
    • (1997) TeXsan for Windows, Version 1.02
  • 57
    • 2942685844 scopus 로고    scopus 로고
    • Unpublished results
    • Ahlrichs, R. Unpublished results.
    • Ahlrichs, R.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.