메뉴 건너뛰기




Volumn 946, Issue 1-3, 2010, Pages 13-19

Experimental and computational study of the energetics of methoxycoumarins

Author keywords

Computational methods; DFT; G3; MCCM; Methoxycoumarin; NICS

Indexed keywords


EID: 77649191652     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2009.11.036     Document Type: Article
Times cited : (8)

References (56)
  • 1
    • 77649187973 scopus 로고    scopus 로고
    • http://mrw.interscience.wiley.com/emrw/9780471238966/kirk/article/coumbois.a01/current/abstract (17/07/09).
    • http://mrw.interscience.wiley.com/emrw/9780471238966/kirk/article/coumbois.a01/current/abstract (17/07/09).
  • 13
    • 77649181266 scopus 로고    scopus 로고
    • E.J. Prosen, J. Res. Nat. Bur. Stand. (US) (1951) Report n°1119.
    • E.J. Prosen, J. Res. Nat. Bur. Stand. (US) (1951) Report n°1119.
  • 17
    • 0002754020 scopus 로고
    • Rossini F.D. (Ed), Interscience, New York (Chapter 14)
    • Rossini F.D. In: Rossini F.D. (Ed). Experimental Thermochemistry vol. 1 (1956), Interscience, New York (Chapter 14)
    • (1956) Experimental Thermochemistry , vol.1
    • Rossini, F.D.1
  • 18
    • 33745021264 scopus 로고
    • CODATA
    • CODATA, J. Chem. Thermodyn. 10 (1978) 903.
    • (1978) J. Chem. Thermodyn , vol.10 , pp. 903
  • 36
    • 77649186100 scopus 로고    scopus 로고
    • M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, J.A. Montgomery Jr, T. Vreven, K.N. Kudin, J.C. Burant, J.M. Millam, S.S. Iyengar, J. Tomasi, V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G.A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, M. Klene, X. Li, J.E. Knox, H.P. Hratchian, J.B. Cross, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, P.Y. Ayala, K. Morokuma, G.A. Voth, P. Salvador, J.J. Dannenberg, V.G. Zakrzewski, S. Dapprich, A.D. Daniels, M.C. Strain, O. Farkas, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J.V. Ortiz, Q. Cui, A.G. Baboul, S. Clifford, J. Cioslowski, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, C. Gon
    • M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, J.A. Montgomery Jr., T. Vreven, K.N. Kudin, J.C. Burant, J.M. Millam, S.S. Iyengar, J. Tomasi, V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G.A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, M. Klene, X. Li, J.E. Knox, H.P. Hratchian, J.B. Cross, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, P.Y. Ayala, K. Morokuma, G.A. Voth, P. Salvador, J.J. Dannenberg, V.G. Zakrzewski, S. Dapprich, A.D. Daniels, M.C. Strain, O. Farkas, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J.V. Ortiz, Q. Cui, A.G. Baboul, S. Clifford, J. Cioslowski, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, C. Gonzalez, J.A. Pople, Gaussian 03, Revision C.02, Gaussian, Inc., Wallingford CT, 2004.
  • 41
    • 77649186183 scopus 로고    scopus 로고
    • Y. Zhao, D.G. Truhlar, MLGAUSS-version 2.0, University of Minnesota, Minneapolis, 2004
    • Y. Zhao, D.G. Truhlar, MLGAUSS-version 2.0, University of Minnesota, Minneapolis, 2004.
  • 50
    • 0000335946 scopus 로고
    • Thermochemical Data and Structures of Organic Compounds
    • TRC: Texas, The enthalpy of formation of all organic compounds will be assumed to be taken from this source if no other reference is given
    • J.B. Pedley, Thermochemical Data and Structures of Organic Compounds, vol. 1. TRC Data Series, TRC: Texas, 1994. The enthalpy of formation of all organic compounds will be assumed to be taken from this source if no other reference is given.
    • (1994) TRC Data Series , vol.1
    • Pedley, J.B.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.