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Volumn 101, Issue 17, 1997, Pages 3400-3403

Thermochemistry of benzvalene, dihydrobenzvalene, and cubane: A high-level computational study

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EID: 0012608076     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp963847j     Document Type: Article
Times cited : (21)

References (30)
  • 5
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    • Smith, B. J.; Radom, L. J. Phys. Chem. 1995,99, 6468. Curtiss, L. A.; Redfern, P. C.; Smith, B. J.; Radom, L. J. Chem Phys. 1996, 104, 5148.
    • (1995) J. Phys. Chem. , vol.99 , pp. 6468
    • Smith, B.J.1    Radom, L.2
  • 16
    • 36449008175 scopus 로고
    • Modifications of the G2 theoretical model with the use of coupled-cluster energies, density-functional geometries, and frequencies have been proposed by Mebel, A. M.; Morokuma; Lin, M. C. J. Chem. Phys. 1995, 103, 7414.
    • (1995) J. Chem. Phys. , vol.103 , pp. 7414
    • Mebel, A.M.1    Morokuma2    Lin, M.C.3
  • 26
    • 0003372586 scopus 로고
    • JANAF Thermochemical Tables
    • U.S. Natl. Bur. Stand.
    • JANAF Thermochemical Tables; Natl. Stand. Ref. Data Ser.; U.S. Natl. Bur. Stand.; 1985; Vol 37.
    • (1985) Natl. Stand. Ref. Data Ser. , vol.37
  • 28
    • 85088226333 scopus 로고    scopus 로고
    • note
    • 25of -1.7 and -2.7 kcal/mol.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.