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Volumn 23, Issue 4, 2004, Pages 755-764

Group 11 metal complexes of N-heterocyclic carbene ligands: Nature of the metal-carbene bond

Author keywords

[No Author keywords available]

Indexed keywords

BONDING; CHEMICAL BONDS; COMPLEXATION; COMPUTATIONAL METHODS; ELECTRONIC STRUCTURE; MATHEMATICAL MODELS; NUMERICAL ANALYSIS; PROBABILITY DENSITY FUNCTION; SINGLE CRYSTALS; SPECTROSCOPIC ANALYSIS; SYNTHESIS (CHEMICAL); X RAY DIFFRACTION ANALYSIS;

EID: 1442334129     PISSN: 02767333     EISSN: None     Source Type: Journal    
DOI: 10.1021/om0341855     Document Type: Article
Times cited : (381)

References (62)
  • 38
    • 1442287332 scopus 로고    scopus 로고
    • note
    • The crystal structure of complex 3 was communicated previously in ref 43. The metric parameters are listed here to compare with those of the isostructural complexes 4 and 5.
  • 45
    • 33744810996 scopus 로고    scopus 로고
    • Vrijie Universiteit: Amsterdam, The Netherlands
    • ADF2002.01; SCM, Theoretical Chemistry, Vrijie Universiteit: Amsterdam, The Netherlands.
    • SCM, Theoretical Chemistry
  • 52
    • 1442311919 scopus 로고    scopus 로고
    • note
    • The unoccupied orbitals are omitted for clarity.
  • 53
    • 1442360797 scopus 로고    scopus 로고
    • note
    • The π orbitals of the ligand fragment are preoccupied, but the π* orbitals are empty, and there is a mixing between these π and π* orbitals when the ligands coordinate to the metal ions. Acocrdingly, the hybrid π/π* orbitals are "partially empty" in the NHC complex.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.