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Volumn 112, Issue 40, 2008, Pages 10017-10022

Similarity based on atomic electrostatic potential in heterocyclic molecules: Acidity of tetrazoles

Author keywords

[No Author keywords available]

Indexed keywords

ACIDS; ATOMIC PHYSICS; BENZENE; BINDING SITES; CORRELATION METHODS; GAS DYNAMICS; GASES; HYDROGEN; HYDROGENATION; HYDROGENOLYSIS; LEARNING SYSTEMS; MOLECULES; OFFSHORE OIL WELL PRODUCTION;

EID: 54849405230     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp804100f     Document Type: Article
Times cited : (7)

References (59)
  • 1
    • 23644453149 scopus 로고    scopus 로고
    • Bultinck, P.; Girones, X.; Carbó-Dorca, R. Molecular Quantum Similarity: Theory and Applications In Reviews in Computational Chemistry; Lipkowitz, K. B., Larter, R., Cundari, T., Eds.; John Wiley and Sons: Hoboken, NJ, 2005; 21, p 127.
    • Bultinck, P.; Girones, X.; Carbó-Dorca, R. Molecular Quantum Similarity: Theory and Applications In Reviews in Computational Chemistry; Lipkowitz, K. B., Larter, R., Cundari, T., Eds.; John Wiley and Sons: Hoboken, NJ, 2005; Vol. 21, p 127.
  • 27
    • 22744443084 scopus 로고    scopus 로고
    • Tetrazoles in Five Membered Heteroarenes with Three or More Heteroatoms
    • Storr, R. C, Gilchrist, T. L, Eds, Thieme Verlag: New York
    • Brigas, F. A. Tetrazoles in Five Membered Heteroarenes with Three or More Heteroatoms. In Science of Synthesis; Storr, R. C., Gilchrist, T. L., Eds., Thieme Verlag: New York, 2004; Vol. 13, p 863.
    • (2004) Science of Synthesis , vol.13 , pp. 863
    • Brigas, F.A.1
  • 31
    • 54849416534 scopus 로고    scopus 로고
    • Frisch, M. J, Trucks, G. W, Schlegel, H. B, Scuseria, G. E, Robb, M. A, Cheeseman, J. R, Zakrzewski, V. G, Montgomery, J. A, Stratmann, R. E, Burant. J. C, Dapprich, S, Millam, J. M; Daniels, A. D, Kudin, K. N, Strain, M. C, Farkas, O, Tomasi, J, Barone, V, Cossi, M, Cammi, R, Mennucci, B, Pomelli, C, Adamo, C, Clifford, S, Ochterski, J, Petersson, G. A, Ayala, P. Y, Cui, Q, Morokuma, K, Malick, D. K, Rabuck, A. D, Raghavachari, K, Foresman, J. B, Cioslowski, J, Ortiz, J. V, Baboul, A. G, Stefanov, B. B, Liu, G, Liashenko, A, Piskorz, P, Komaromi, I, Gomperts R, Martin, R. L, Fox D. J, Keith T, Al-Laham, M. A, Peng, C. Y, Nanayakkara, A, Gonzales, C, Challacombe, M, Gill, P. M. W, Johnson, B, Chen, W, Wong, M. W, Andres, J. L, Head-Gordon, M, Replogle, E. S, Pople, J. A. Gaussian 98, Revision A.7, Gaussian, Inc, Pittsburgh, PA, 1998
    • Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A.; Stratmann, R. E.; Burant. J. C.; Dapprich, S.; Millam, J. M; Daniels, A. D.; Kudin, K. N.; Strain, M. C.; Farkas, O.; Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B.; Pomelli, C.; Adamo, C.; Clifford, S.; Ochterski, J.; Petersson, G. A.; Ayala, P. Y.; Cui, Q.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Cioslowski, J.; Ortiz, J. V.; Baboul, A. G.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Gomperts R.; Martin, R. L.; Fox D. J.; Keith T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Gonzales, C.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Andres, J. L.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian 98, Revision A.7, Gaussian, Inc., Pittsburgh, PA, 1998.
  • 32
    • 54849417950 scopus 로고    scopus 로고
    • Spartan version 5.0, Wavefunction, Inc, Irvine, CA
    • Spartan version 5.0, Wavefunction, Inc., Irvine, CA.
  • 35
    • 54849413154 scopus 로고    scopus 로고
    • Biegler-König, F, Schönbohm, J. AIM 2000, version 2.0
    • Biegler-König, F.; Schönbohm, J. AIM 2000, version 2.0.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.