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Volumn 132, Issue 1, 2010, Pages 215-222

Vinyl cations substituted with β π-donors have triplet ground states

Author keywords

[No Author keywords available]

Indexed keywords

2-METHYLENE; CARBENES; CBS-QB3; CLOSED SHELLS; GROUND ELECTRONIC STATE; PHENYL CATIONS; REACTION CHEMISTRY; SINGLET STATE; TRIPLET STATE; VINYL CATIONS;

EID: 74849110866     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja906139m     Document Type: Article
Times cited : (30)

References (77)
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  • 65
    • 74849126448 scopus 로고    scopus 로고
    • However, given that DFT underestimates singlet stability by 3-6 kcal/ mol, the ground state is probably the singlet.
    • However, given that DFT underestimates singlet stability by 3-6 kcal/ mol, the ground state is probably the singlet.
  • 72
    • 74849092485 scopus 로고    scopus 로고
    • Frisch, M. J. T. Gaussian03, rev. B.03; Pittsburgh, PA, 2003.
    • Frisch, M. J. T. Gaussian03, rev. B.03; Pittsburgh, PA, 2003.
  • 73
    • 0004007161 scopus 로고    scopus 로고
    • 7 ed, Lund, Sweden
    • Andersson, K. Molcas, 7 ed.; Lund, Sweden, 2000.
    • (2000) Molcas
    • Andersson, K.1
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    • 0344791553 scopus 로고
    • (b) Ziegler, T. Chem. Rev. 1991, 91, 651-667.
    • (1991) Chem. Rev , vol.91 , pp. 651-667
    • Ziegler, T.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.