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Volumn 15, Issue 16, 1996, Pages 3563-3571

Mechanistic studies of the 1,4-Cis polymerization of butadiene according to the π-allyl insertion mechanism. 1. Density functional study of the C-C bond formation reaction in cationic (η3-Allyl)(η2-η 4-butadiene)nickel(II) complexes [Ni(C3H5)(C4H6)]+

Author keywords

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Indexed keywords


EID: 0000440439     PISSN: 02767333     EISSN: None     Source Type: Journal    
DOI: 10.1021/om960038d     Document Type: Article
Times cited : (44)

References (44)
  • 8
    • 0000025250 scopus 로고
    • Ketley, A. D., Ed.; Marcel Dekker Inc.: New York
    • (a) Cossee, P. In Stereochemistry of Macromolecules; Ketley, A. D., Ed.; Marcel Dekker Inc.: New York, 1967; Vol. 1, p 145.
    • (1967) Stereochemistry of Macromolecules , vol.1 , pp. 145
    • Cossee, P.1
  • 33
    • 0003442182 scopus 로고
    • Labanowski, J.; Andzelm, J., Eds.; Springer: Berlin, DGauss and UniChem are software packages available from Cray Research
    • (b) Andzelm, J. In Density Functional Methods in Chemistry; Labanowski, J.; Andzelm, J., Eds.; Springer: Berlin, 1991. DGauss and UniChem are software packages available from Cray Research.
    • (1991) Density Functional Methods in Chemistry
    • Andzelm, J.1
  • 39
    • 5244285323 scopus 로고    scopus 로고
    • DGauss basis set library
    • (a) DGauss basis set library.
  • 41
    • 5244264332 scopus 로고    scopus 로고
    • Unpublished data
    • Tobisch, S. Unpublished data.
    • Tobisch, S.1
  • 44
    • 85088542632 scopus 로고    scopus 로고
    • note
    • 3 hybridization, values of 0°/35.3° are expected.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.