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Volumn 37, Issue 24, 1998, Pages 6317-6328

Experimental Charge Density and Neutron Structural Study of cis-HMn(CO)4PPh3: Comprehensive Analysis of Chemical Bonding and Evidence for a C-H⋯H-Mn Hydrogen Bond

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EID: 0000895394     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic9809660     Document Type: Article
Times cited : (67)

References (115)
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    • References 5 and 6 report charge density studies using CCD area detectors based upon synchrotron and sealed-tube X-ray sources, respectively, (a) Korizánsky, T.; Flaig, R.; Zobel, D.; Krane, H.-G.; Morgenroth, W.; Luger, P. Science 1998, 279, 356. (b) Graafsma, H.; Svensson, S. O.; Kvick, Å. J. Appl. Crystallogr. 1997, 30, 957.
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    • note
    • 7d
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    • note
    • 32b Angles exceeding 180° refer to carbonyl groups oriented away from the halogen.
  • 77
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    • note
    • 33a
  • 81
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    • note
    • 35b
  • 91
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    • note
    • 43b-d
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    • note
    • Principal curvatures refer to the eigenvalues of the diagonalized matrix of second derivatives of ρ at the CP.
  • 104
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    • note
    • 2ρ (opposite sign!) in marked disagreement with other determinations.
  • 108
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    • note
    • Exact quantitative agreement should not be expected, not least because of the chemical differences between molecular CO and a carbonyl ligand (vide infra).
  • 109
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    • note
    • 53b
  • 113
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    • note
    • 2ρ in this region,


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.