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Volumn 134, Issue 44, 2012, Pages 18253-18256

Elusive metal-free primary amination of arylboronic acids: Synthetic studies and mechanism by density functional theory

Author keywords

[No Author keywords available]

Indexed keywords

ARYL AMINES; ARYLBORONIC ACIDS; BASIC CONDITIONS; CHEMICAL YIELDS; MULTI-GRAM QUANTITIES; NITRO GROUP; PRIMARY AROMATIC AMINES; SYNTHETIC CHEMISTS; SYNTHETIC STUDY;

EID: 84868578140     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja309637r     Document Type: Article
Times cited : (129)

References (51)
  • 11
    • 84879387027 scopus 로고    scopus 로고
    • 2 nd ed. Hall, D. G. Wiley-VCH: Weinheim
    • Qiao, J. X.; Lam, P. Y. S. In Boronic Acids, 2 nd ed.; Hall, D. G., Ed.; Wiley-VCH: Weinheim, 2011; Vol. 1, p 315.
    • (2011) Boronic Acids , vol.1 , pp. 315
    • Qiao, J.X.1    Lam, P.Y.S.2
  • 29
    • 84868254749 scopus 로고    scopus 로고
    • 2 nd ed. Hall, D. G. Wiley-VCH: Weinheim
    • Hall, D. G. In Boronic Acids, 2 nd ed.; Hall, D. G., Ed.; Wiley-VCH: Weinheim, 2011; Vol. 1, p 1.
    • (2011) Boronic Acids , vol.1 , pp. 1
    • Hall, D.G.1
  • 43
    • 84876811074 scopus 로고    scopus 로고
    • All calculations were performed in Gaussian 09 with the M06-2X/6-31G(d,p) functional and basis set in conjunction with the SMD solvent model for toluene. All structures were confirmed as minima or saddle points through normal mode analysis and free energies are reported at 298 K
    • All calculations were performed in Gaussian 09 with the M06-2X/6-31G(d,p) functional and basis set in conjunction with the SMD solvent model for toluene. All structures were confirmed as minima or saddle points through normal mode analysis and free energies are reported at 298 K.
  • 44
    • 70450206724 scopus 로고    scopus 로고
    • revision A.02; Gaussian, Inc. Wallingford, CT
    • Frisch, M. J.; Gaussian 09, revision A.02; Gaussian, Inc.: Wallingford, CT, 2009.
    • (2009) Gaussian 09
    • Frisch, M.J.1
  • 48
    • 84876812377 scopus 로고    scopus 로고
    • ‡ values computed for TS-1 using the B3LYP, B97XD, and BMK functionals with the 6-31G(d,p) basis set are 26.1, 28.7, and 30.2 kcal/mol, respectively
    • ‡ values computed for TS-1 using the B3LYP, B97XD, and BMK functionals with the 6-31G(d,p) basis set are 26.1, 28.7, and 30.2 kcal/mol, respectively.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.