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Volumn 62, Issue 11, 1997, Pages 3702-3704

Conformational Analysis with Carbon-Carbon Coupling Constants. A Density Functional and Molecular Mechanics Study

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EID: 0000576559     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo970061o     Document Type: Article
Times cited : (27)

References (27)
  • 1
    • 0000314027 scopus 로고
    • Hoffmann, R. W. Angew. Chem. 1992, 104, 1147; Angew. Chem. Int. Ed. Engl. 1992, 31, 1697.
    • (1992) Angew. Chem. , vol.104 , pp. 1147
    • Hoffmann, R.W.1
  • 2
    • 0000097250 scopus 로고
    • Hoffmann, R. W. Angew. Chem. 1992, 104, 1147; Angew. Chem. Int. Ed. Engl. 1992, 31, 1697.
    • (1992) Angew. Chem. Int. Ed. Engl. , vol.31 , pp. 1697
  • 8
    • 0039699045 scopus 로고
    • 3Jcc coupling constants in hydrocarbons have earlier been calculated by means of an INDO-based semiempirical method: (a) Barfield, M.; Burfitt, I.; Doddrell, D. J. Am. Chem. Soc. 1975, 97, 2631. (b) Sverson, M. L., Maciel, G. E. J. Magn. Reson. 1984, 57, 248.
    • (1975) J. Am. Chem. Soc. , vol.97 , pp. 2631
    • Barfield, M.1    Burfitt, I.2    Doddrell, D.3
  • 9
    • 0003629284 scopus 로고
    • 3Jcc coupling constants in hydrocarbons have earlier been calculated by means of an INDO-based semiempirical method: (a) Barfield, M.; Burfitt, I.; Doddrell, D. J. Am. Chem. Soc. 1975, 97, 2631. (b) Sverson, M. L., Maciel, G. E. J. Magn. Reson. 1984, 57, 248.
    • (1984) J. Magn. Reson. , vol.57 , pp. 248
    • Sverson, M.L.1    Maciel, G.E.2
  • 18
    • 0344568834 scopus 로고    scopus 로고
    • Department of Chemistry, Columbia University, New York, NY 10027
    • Macromodel 4.5, Department of Chemistry, Columbia University, New York, NY 10027.
    • Macromodel 4.5
  • 24
    • 85033142310 scopus 로고    scopus 로고
    • deMon 1.0, A Gaussian Density Functional Program, University of Montreal
    • deMon 1.0, A Gaussian Density Functional Program, University of Montreal.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.