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Volumn 70, Issue 4, 2005, Pages 1122-1133

An experimental and computational investigation of the Diels-Alder cycloadditions of halogen-substituted 2(H)-pyran-2-ones

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; ELECTRON TRANSITIONS; PROBABILITY DENSITY FUNCTION; STEREOCHEMISTRY;

EID: 13844306924     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo048213k     Document Type: Article
Times cited : (57)

References (42)
  • 39
    • 0000014251 scopus 로고
    • We used the 6-31G* basis for all elements other than iodine. For iodine, we used the 6-311G* all-electron basis defined in: Glukhovtsev, M. N.; Pross, A.; McGrath M. P.; Radom, L. J. Chem. Phys. 1995, 103, 1878. Taken from the Extensible Computational Chemistry Environment Basis Set Database, Version 12/03/03, as developed and distributed by the Molecular Science Computing Facility, Environmental and Molecular Sciences Laboratory which is part of the Pacific Northwest Laboratory, P.O. Box 999, Richland, WA 99352, and funded by the U.S. Department of Energy.
    • (1995) J. Chem. Phys. , vol.103 , pp. 1878
    • Glukhovtsev, M.N.1    Pross, A.2    McGrath, M.P.3    Radom, L.4


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.