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Volumn 131, Issue 13, 2009, Pages 4604-4605

Activation of an alkyl C-H bond geminal to an agostic interaction: An unusual mode of base-induced C-H activation

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVATION BARRIERS; AGOSTIC INTERACTIONS; C-H ACTIVATION; C-H BOND; CH-BOND ACTIVATION; CHARGE ANALYSIS; COMPUTATIONAL STUDIES; DEUTERIUM LABELING; INTRAMOLECULAR C-H ACTIVATION; N-HETEROCYCLIC CARBENE LIGANDS; ROOM TEMPERATURE;

EID: 67949097274     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja900953d     Document Type: Article
Times cited : (83)

References (27)
  • 1
    • 67949091646 scopus 로고    scopus 로고
    • Brookhart, M.; Green, M. L. H. J. Organomet. Chem. 1983, 250, 395. (b) Brookhart, M.; Green, M. L. H.; Wong, L.-L. Prog. Inorg. Chem. 1988, 36, 1.
    • (a) Brookhart, M.; Green, M. L. H. J. Organomet. Chem. 1983, 250, 395. (b) Brookhart, M.; Green, M. L. H.; Wong, L.-L. Prog. Inorg. Chem. 1988, 36, 1.
  • 3
    • 11044227008 scopus 로고    scopus 로고
    • ActiVation and Functionalization of C-H
    • Bonds; Goldman, A. S, Goldberg, K. I, Eds, American Chemical Society: Washington, DC
    • (a) Goldman, A. S.; Goldberg, K. I. In ActiVation and Functionalization of C-H Bonds; Goldman, A. S.; Goldberg, K. I., Eds.; ACS Symposium Series 885; American Chemical Society: Washington, DC, 2004; p 1.
    • (2004) ACS Symposium Series , vol.885 , pp. 1
    • Goldman, A.S.1    Goldberg, K.I.2
  • 8
    • 0001101373 scopus 로고    scopus 로고
    • Direct observation of this process is rather rare. Aromatic C-H bonds: (a) Speckman, D. M.; Knobler, C. B.; Hawthorne, M. F. Organometallics 1985, 4, 426.
    • Direct observation of this process is rather rare. Aromatic C-H bonds: (a) Speckman, D. M.; Knobler, C. B.; Hawthorne, M. F. Organometallics 1985, 4, 426.
  • 17
    • 67949114744 scopus 로고    scopus 로고
    • C-H reductive elimination from 1 and deuteration of the resultant Ru(0) intermediate would account for the exclusive formation of 2-D.
    • C-H reductive elimination from 1 and deuteration of the resultant Ru(0) intermediate would account for the exclusive formation of 2-D.
  • 18
    • 67949087193 scopus 로고    scopus 로고
    • Frisch, M. et al. Gaussian 03, revision D.01; Gaussian, Inc.: Pittsburgh, PA, 2001. The BP86 functional was employed with SDD RECPs and basis sets on Ru and P (with d-orbital polarisation on the latter) and 6-31G** basis sets on all other atoms. Energies include a correction for zero-point energies. See Supporting Information for full details.
    • Frisch, M. et al. Gaussian 03, revision D.01; Gaussian, Inc.: Pittsburgh, PA, 2001. The BP86 functional was employed with SDD RECPs and basis sets on Ru and P (with d-orbital polarisation on the latter) and 6-31G** basis sets on all other atoms. Energies include a correction for zero-point energies. See Supporting Information for full details.
  • 24
    • 84869572181 scopus 로고    scopus 로고
    • Solvent effects (THF, PCM method) reduce ΔE‡ to 10.3 kcal/mol.
    • Solvent effects (THF, PCM method) reduce ΔE‡ to 10.3 kcal/mol.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.