메뉴 건너뛰기




Volumn 370, Issue 1, 1996, Pages 85-91

Density functional study of N-methylpyrrole transformation into N-methylisoindole through cycloaddition-elimination reactions

Author keywords

Cycoaddition elimination reaction; Density functional theory; N Methlisoindole; N Methylpyrrole

Indexed keywords


EID: 0004779780     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(96)04672-6     Document Type: Article
Times cited : (23)

References (73)
  • 1
    • 0003719612 scopus 로고
    • Academic Press, New York
    • D.L. Boger and S.N. Weinreb, Hetero Diels-Alder Methodology in Organic Synthesis, Academic Press, New York, 1987. T. Kametani and S. Hibino, Advances in Heterocyclic Chemistry, Vol. 42, Academic Press, New York, 1987, Chapter 2. J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967. M. Jung, E. Shishido, K.L. Light and L. Devis, Tetrahedron Lett., (1981) 4607. F. Jensen and C. Foote, J. Am. Chem. Soc., 109 (1987) 6376. B. Nader, T.R. Bailey, R.W. Franck and S.M. Weinreb, J. Am. Chem. Soc., 103 (1981) 7573. L. Le Coz, C. Veyrat-Martin, L. Wartski, J. Seyden-Penne, C. Bois and M. Philoche-Levisalles, J. Org. Chem., 55 (1990) 4870. S.J. Danishefsky, E. Askin, D. Larson and N. Kato, J. Am. Chem. Soc., 107 (1985) 1246. S.J. Danishefsky, H.G. Selznik, R.E. Zelle and M.P. Deninno, J. Am. Chem. Soc., 110 (1988) 4368. S.J. Danishefsky, D.C. Myles and D.F. Harrey, J. Am. Chem. Soc., 109 (1987) 862. M. Bednarsky and S.J. Danishefsky, J. Am. Chem. Soc., 108 (1986) 7060. K.F. McCule, J.W. Benbow and S.J. Danishefsky, J. Am. Chem. Soc., 113 (1991) 8185.
    • (1987) Hetero Diels-Alder Methodology in Organic Synthesis
    • Boger, D.L.1    Weinreb, S.N.2
  • 2
    • 0000369566 scopus 로고
    • Academic Press, New York, Chapter 2
    • D.L. Boger and S.N. Weinreb, Hetero Diels-Alder Methodology in Organic Synthesis, Academic Press, New York, 1987. T. Kametani and S. Hibino, Advances in Heterocyclic Chemistry, Vol. 42, Academic Press, New York, 1987, Chapter 2. J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967. M. Jung, E. Shishido, K.L. Light and L. Devis, Tetrahedron Lett., (1981) 4607. F. Jensen and C. Foote, J. Am. Chem. Soc., 109 (1987) 6376. B. Nader, T.R. Bailey, R.W. Franck and S.M. Weinreb, J. Am. Chem. Soc., 103 (1981) 7573. L. Le Coz, C. Veyrat-Martin, L. Wartski, J. Seyden-Penne, C. Bois and M. Philoche-Levisalles, J. Org. Chem., 55 (1990) 4870. S.J. Danishefsky, E. Askin, D. Larson and N. Kato, J. Am. Chem. Soc., 107 (1985) 1246. S.J. Danishefsky, H.G. Selznik, R.E. Zelle and M.P. Deninno, J. Am. Chem. Soc., 110 (1988) 4368. S.J. Danishefsky, D.C. Myles and D.F. Harrey, J. Am. Chem. Soc., 109 (1987) 862. M. Bednarsky and S.J. Danishefsky, J. Am. Chem. Soc., 108 (1986) 7060. K.F. McCule, J.W. Benbow and S.J. Danishefsky, J. Am. Chem. Soc., 113 (1991) 8185.
    • (1987) Advances in Heterocyclic Chemistry , vol.42
    • Kametani, T.1    Hibino, S.2
  • 3
    • 0003862892 scopus 로고
    • Academic Press, New York
    • D.L. Boger and S.N. Weinreb, Hetero Diels-Alder Methodology in Organic Synthesis, Academic Press, New York, 1987. T. Kametani and S. Hibino, Advances in Heterocyclic Chemistry, Vol. 42, Academic Press, New York, 1987, Chapter 2. J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967. M. Jung, E. Shishido, K.L. Light and L. Devis, Tetrahedron Lett., (1981) 4607. F. Jensen and C. Foote, J. Am. Chem. Soc., 109 (1987) 6376. B. Nader, T.R. Bailey, R.W. Franck and S.M. Weinreb, J. Am. Chem. Soc., 103 (1981) 7573. L. Le Coz, C. Veyrat-Martin, L. Wartski, J. Seyden-Penne, C. Bois and M. Philoche-Levisalles, J. Org. Chem., 55 (1990) 4870. S.J. Danishefsky, E. Askin, D. Larson and N. Kato, J. Am. Chem. Soc., 107 (1985) 1246. S.J. Danishefsky, H.G. Selznik, R.E. Zelle and M.P. Deninno, J. Am. Chem. Soc., 110 (1988) 4368. S.J. Danishefsky, D.C. Myles and D.F. Harrey, J. Am. Chem. Soc., 109 (1987) 862. M. Bednarsky and S.J. Danishefsky, J. Am. Chem. Soc., 108 (1986) 7060. K.F. McCule, J.W. Benbow and S.J. Danishefsky, J. Am. Chem. Soc., 113 (1991) 8185.
    • (1967) 1,4-cycloaddition Reactions
    • Hamer, J.1
  • 4
    • 0001093165 scopus 로고
    • D.L. Boger and S.N. Weinreb, Hetero Diels-Alder Methodology in Organic Synthesis, Academic Press, New York, 1987. T. Kametani and S. Hibino, Advances in Heterocyclic Chemistry, Vol. 42, Academic Press, New York, 1987, Chapter 2. J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967. M. Jung, E. Shishido, K.L. Light and L. Devis, Tetrahedron Lett., (1981) 4607. F. Jensen and C. Foote, J. Am. Chem. Soc., 109 (1987) 6376. B. Nader, T.R. Bailey, R.W. Franck and S.M. Weinreb, J. Am. Chem. Soc., 103 (1981) 7573. L. Le Coz, C. Veyrat-Martin, L. Wartski, J. Seyden-Penne, C. Bois and M. Philoche-Levisalles, J. Org. Chem., 55 (1990) 4870. S.J. Danishefsky, E. Askin, D. Larson and N. Kato, J. Am. Chem. Soc., 107 (1985) 1246. S.J. Danishefsky, H.G. Selznik, R.E. Zelle and M.P. Deninno, J. Am. Chem. Soc., 110 (1988) 4368. S.J. Danishefsky, D.C. Myles and D.F. Harrey, J. Am. Chem. Soc., 109 (1987) 862. M. Bednarsky and S.J. Danishefsky, J. Am. Chem. Soc., 108 (1986) 7060. K.F. McCule, J.W. Benbow and S.J. Danishefsky, J. Am. Chem. Soc., 113 (1991) 8185.
    • (1981) Tetrahedron Lett., , pp. 4607
    • Jung, M.1    Shishido, E.2    Light, K.L.3    Devis, L.4
  • 5
    • 33845281275 scopus 로고
    • D.L. Boger and S.N. Weinreb, Hetero Diels-Alder Methodology in Organic Synthesis, Academic Press, New York, 1987. T. Kametani and S. Hibino, Advances in Heterocyclic Chemistry, Vol. 42, Academic Press, New York, 1987, Chapter 2. J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967. M. Jung, E. Shishido, K.L. Light and L. Devis, Tetrahedron Lett., (1981) 4607. F. Jensen and C. Foote, J. Am. Chem. Soc., 109 (1987) 6376. B. Nader, T.R. Bailey, R.W. Franck and S.M. Weinreb, J. Am. Chem. Soc., 103 (1981) 7573. L. Le Coz, C. Veyrat-Martin, L. Wartski, J. Seyden-Penne, C. Bois and M. Philoche-Levisalles, J. Org. Chem., 55 (1990) 4870. S.J. Danishefsky, E. Askin, D. Larson and N. Kato, J. Am. Chem. Soc., 107 (1985) 1246. S.J. Danishefsky, H.G. Selznik, R.E. Zelle and M.P. Deninno, J. Am. Chem. Soc., 110 (1988) 4368. S.J. Danishefsky, D.C. Myles and D.F. Harrey, J. Am. Chem. Soc., 109 (1987) 862. M. Bednarsky and S.J. Danishefsky, J. Am. Chem. Soc., 108 (1986) 7060. K.F. McCule, J.W. Benbow and S.J. Danishefsky, J. Am. Chem. Soc., 113 (1991) 8185.
    • (1987) J. Am. Chem. Soc. , vol.109 , pp. 6376
    • Jensen, F.1    Foote, C.2
  • 6
    • 0001403614 scopus 로고
    • D.L. Boger and S.N. Weinreb, Hetero Diels-Alder Methodology in Organic Synthesis, Academic Press, New York, 1987. T. Kametani and S. Hibino, Advances in Heterocyclic Chemistry, Vol. 42, Academic Press, New York, 1987, Chapter 2. J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967. M. Jung, E. Shishido, K.L. Light and L. Devis, Tetrahedron Lett., (1981) 4607. F. Jensen and C. Foote, J. Am. Chem. Soc., 109 (1987) 6376. B. Nader, T.R. Bailey, R.W. Franck and S.M. Weinreb, J. Am. Chem. Soc., 103 (1981) 7573. L. Le Coz, C. Veyrat-Martin, L. Wartski, J. Seyden-Penne, C. Bois and M. Philoche-Levisalles, J. Org. Chem., 55 (1990) 4870. S.J. Danishefsky, E. Askin, D. Larson and N. Kato, J. Am. Chem. Soc., 107 (1985) 1246. S.J. Danishefsky, H.G. Selznik, R.E. Zelle and M.P. Deninno, J. Am. Chem. Soc., 110 (1988) 4368. S.J. Danishefsky, D.C. Myles and D.F. Harrey, J. Am. Chem. Soc., 109 (1987) 862. M. Bednarsky and S.J. Danishefsky, J. Am. Chem. Soc., 108 (1986) 7060. K.F. McCule, J.W. Benbow and S.J. Danishefsky, J. Am. Chem. Soc., 113 (1991) 8185.
    • (1981) J. Am. Chem. Soc. , vol.103 , pp. 7573
    • Nader, B.1    Bailey, T.R.2    Franck, R.W.3    Weinreb, S.M.4
  • 7
    • 20844444253 scopus 로고
    • D.L. Boger and S.N. Weinreb, Hetero Diels-Alder Methodology in Organic Synthesis, Academic Press, New York, 1987. T. Kametani and S. Hibino, Advances in Heterocyclic Chemistry, Vol. 42, Academic Press, New York, 1987, Chapter 2. J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967. M. Jung, E. Shishido, K.L. Light and L. Devis, Tetrahedron Lett., (1981) 4607. F. Jensen and C. Foote, J. Am. Chem. Soc., 109 (1987) 6376. B. Nader, T.R. Bailey, R.W. Franck and S.M. Weinreb, J. Am. Chem. Soc., 103 (1981) 7573. L. Le Coz, C. Veyrat-Martin, L. Wartski, J. Seyden-Penne, C. Bois and M. Philoche-Levisalles, J. Org. Chem., 55 (1990) 4870. S.J. Danishefsky, E. Askin, D. Larson and N. Kato, J. Am. Chem. Soc., 107 (1985) 1246. S.J. Danishefsky, H.G. Selznik, R.E. Zelle and M.P. Deninno, J. Am. Chem. Soc., 110 (1988) 4368. S.J. Danishefsky, D.C. Myles and D.F. Harrey, J. Am. Chem. Soc., 109 (1987) 862. M. Bednarsky and S.J. Danishefsky, J. Am. Chem. Soc., 108 (1986) 7060. K.F. McCule, J.W. Benbow and S.J. Danishefsky, J. Am. Chem. Soc., 113 (1991) 8185.
    • (1990) J. Org. Chem. , vol.55 , pp. 4870
    • Le Coz, L.1    Veyrat-Martin, C.2    Wartski, L.3    Seyden-Penne, J.4    Bois, C.5    Philoche-Levisalles, M.6
  • 8
    • 0000284024 scopus 로고
    • D.L. Boger and S.N. Weinreb, Hetero Diels-Alder Methodology in Organic Synthesis, Academic Press, New York, 1987. T. Kametani and S. Hibino, Advances in Heterocyclic Chemistry, Vol. 42, Academic Press, New York, 1987, Chapter 2. J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967. M. Jung, E. Shishido, K.L. Light and L. Devis, Tetrahedron Lett., (1981) 4607. F. Jensen and C. Foote, J. Am. Chem. Soc., 109 (1987) 6376. B. Nader, T.R. Bailey, R.W. Franck and S.M. Weinreb, J. Am. Chem. Soc., 103 (1981) 7573. L. Le Coz, C. Veyrat-Martin, L. Wartski, J. Seyden-Penne, C. Bois and M. Philoche-Levisalles, J. Org. Chem., 55 (1990) 4870. S.J. Danishefsky, E. Askin, D. Larson and N. Kato, J. Am. Chem. Soc., 107 (1985) 1246. S.J. Danishefsky, H.G. Selznik, R.E. Zelle and M.P. Deninno, J. Am. Chem. Soc., 110 (1988) 4368. S.J. Danishefsky, D.C. Myles and D.F. Harrey, J. Am. Chem. Soc., 109 (1987) 862. M. Bednarsky and S.J. Danishefsky, J. Am. Chem. Soc., 108 (1986) 7060. K.F. McCule, J.W. Benbow and S.J. Danishefsky, J. Am. Chem. Soc., 113 (1991) 8185.
    • (1985) J. Am. Chem. Soc. , vol.107 , pp. 1246
    • Danishefsky, S.J.1    Askin, E.2    Larson, D.3    Kato, N.4
  • 9
    • 0023903957 scopus 로고
    • D.L. Boger and S.N. Weinreb, Hetero Diels-Alder Methodology in Organic Synthesis, Academic Press, New York, 1987. T. Kametani and S. Hibino, Advances in Heterocyclic Chemistry, Vol. 42, Academic Press, New York, 1987, Chapter 2. J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967. M. Jung, E. Shishido, K.L. Light and L. Devis, Tetrahedron Lett., (1981) 4607. F. Jensen and C. Foote, J. Am. Chem. Soc., 109 (1987) 6376. B. Nader, T.R. Bailey, R.W. Franck and S.M. Weinreb, J. Am. Chem. Soc., 103 (1981) 7573. L. Le Coz, C. Veyrat-Martin, L. Wartski, J. Seyden-Penne, C. Bois and M. Philoche-Levisalles, J. Org. Chem., 55 (1990) 4870. S.J. Danishefsky, E. Askin, D. Larson and N. Kato, J. Am. Chem. Soc., 107 (1985) 1246. S.J. Danishefsky, H.G. Selznik, R.E. Zelle and M.P. Deninno, J. Am. Chem. Soc., 110 (1988) 4368. S.J. Danishefsky, D.C. Myles and D.F. Harrey, J. Am. Chem. Soc., 109 (1987) 862. M. Bednarsky and S.J. Danishefsky, J. Am. Chem. Soc., 108 (1986) 7060. K.F. McCule, J.W. Benbow and S.J. Danishefsky, J. Am. Chem. Soc., 113 (1991) 8185.
    • (1988) J. Am. Chem. Soc. , vol.110 , pp. 4368
    • Danishefsky, S.J.1    Selznik, H.G.2    Zelle, R.E.3    Deninno, M.P.4
  • 10
    • 0000040552 scopus 로고
    • D.L. Boger and S.N. Weinreb, Hetero Diels-Alder Methodology in Organic Synthesis, Academic Press, New York, 1987. T. Kametani and S. Hibino, Advances in Heterocyclic Chemistry, Vol. 42, Academic Press, New York, 1987, Chapter 2. J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967. M. Jung, E. Shishido, K.L. Light and L. Devis, Tetrahedron Lett., (1981) 4607. F. Jensen and C. Foote, J. Am. Chem. Soc., 109 (1987) 6376. B. Nader, T.R. Bailey, R.W. Franck and S.M. Weinreb, J. Am. Chem. Soc., 103 (1981) 7573. L. Le Coz, C. Veyrat-Martin, L. Wartski, J. Seyden-Penne, C. Bois and M. Philoche-Levisalles, J. Org. Chem., 55 (1990) 4870. S.J. Danishefsky, E. Askin, D. Larson and N. Kato, J. Am. Chem. Soc., 107 (1985) 1246. S.J. Danishefsky, H.G. Selznik, R.E. Zelle and M.P. Deninno, J. Am. Chem. Soc., 110 (1988) 4368. S.J. Danishefsky, D.C. Myles and D.F. Harrey, J. Am. Chem. Soc., 109 (1987) 862. M. Bednarsky and S.J. Danishefsky, J. Am. Chem. Soc., 108 (1986) 7060. K.F. McCule, J.W. Benbow and S.J. Danishefsky, J. Am. Chem. Soc., 113 (1991) 8185.
    • (1987) J. Am. Chem. Soc. , vol.109 , pp. 862
    • Danishefsky, S.J.1    Myles, D.C.2    Harrey, D.F.3
  • 11
    • 0001349508 scopus 로고
    • D.L. Boger and S.N. Weinreb, Hetero Diels-Alder Methodology in Organic Synthesis, Academic Press, New York, 1987. T. Kametani and S. Hibino, Advances in Heterocyclic Chemistry, Vol. 42, Academic Press, New York, 1987, Chapter 2. J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967. M. Jung, E. Shishido, K.L. Light and L. Devis, Tetrahedron Lett., (1981) 4607. F. Jensen and C. Foote, J. Am. Chem. Soc., 109 (1987) 6376. B. Nader, T.R. Bailey, R.W. Franck and S.M. Weinreb, J. Am. Chem. Soc., 103 (1981) 7573. L. Le Coz, C. Veyrat-Martin, L. Wartski, J. Seyden-Penne, C. Bois and M. Philoche-Levisalles, J. Org. Chem., 55 (1990) 4870. S.J. Danishefsky, E. Askin, D. Larson and N. Kato, J. Am. Chem. Soc., 107 (1985) 1246. S.J. Danishefsky, H.G. Selznik, R.E. Zelle and M.P. Deninno, J. Am. Chem. Soc., 110 (1988) 4368. S.J. Danishefsky, D.C. Myles and D.F. Harrey, J. Am. Chem. Soc., 109 (1987) 862. M. Bednarsky and S.J. Danishefsky, J. Am. Chem. Soc., 108 (1986) 7060. K.F. McCule, J.W. Benbow and S.J. Danishefsky, J. Am. Chem. Soc., 113 (1991) 8185.
    • (1986) J. Am. Chem. Soc. , vol.108 , pp. 7060
    • Bednarsky, M.1    Danishefsky, S.J.2
  • 12
    • 0026075841 scopus 로고
    • D.L. Boger and S.N. Weinreb, Hetero Diels-Alder Methodology in Organic Synthesis, Academic Press, New York, 1987. T. Kametani and S. Hibino, Advances in Heterocyclic Chemistry, Vol. 42, Academic Press, New York, 1987, Chapter 2. J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967. M. Jung, E. Shishido, K.L. Light and L. Devis, Tetrahedron Lett., (1981) 4607. F. Jensen and C. Foote, J. Am. Chem. Soc., 109 (1987) 6376. B. Nader, T.R. Bailey, R.W. Franck and S.M. Weinreb, J. Am. Chem. Soc., 103 (1981) 7573. L. Le Coz, C. Veyrat-Martin, L. Wartski, J. Seyden-Penne, C. Bois and M. Philoche-Levisalles, J. Org. Chem., 55 (1990) 4870. S.J. Danishefsky, E. Askin, D. Larson and N. Kato, J. Am. Chem. Soc., 107 (1985) 1246. S.J. Danishefsky, H.G. Selznik, R.E. Zelle and M.P. Deninno, J. Am. Chem. Soc., 110 (1988) 4368. S.J. Danishefsky, D.C. Myles and D.F. Harrey, J. Am. Chem. Soc., 109 (1987) 862. M. Bednarsky and S.J. Danishefsky, J. Am. Chem. Soc., 108 (1986) 7060. K.F. McCule, J.W. Benbow and S.J. Danishefsky, J. Am. Chem. Soc., 113 (1991) 8185.
    • (1991) J. Am. Chem. Soc. , vol.113 , pp. 8185
    • McCule, K.F.1    Benbow, J.W.2    Danishefsky, S.J.3
  • 13
    • 0002491291 scopus 로고
    • R.R. Schmidt, Acc. Chem. Res., 19 (1986) 250. S. Hanessian, Total Synthesis of Natural Products. The Chiron Approach, Pergamon Press, Oxford, 1983 J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967.
    • (1986) Acc. Chem. Res. , vol.19 , pp. 250
    • Schmidt, R.R.1
  • 14
    • 0002491291 scopus 로고
    • The Chiron Approach, Pergamon Press, Oxford
    • R.R. Schmidt, Acc. Chem. Res., 19 (1986) 250. S. Hanessian, Total Synthesis of Natural Products. The Chiron Approach, Pergamon Press, Oxford, 1983 J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967.
    • (1983) Total Synthesis of Natural Products
    • Hanessian, S.1
  • 15
    • 0002491291 scopus 로고
    • Academic Press, New York
    • R.R. Schmidt, Acc. Chem. Res., 19 (1986) 250. S. Hanessian, Total Synthesis of Natural Products. The Chiron Approach, Pergamon Press, Oxford, 1983 J. Hamer (Ed.), 1,4-Cycloaddition Reactions, Academic Press, New York, 1967.
    • (1967) 1,4-cycloaddition Reactions
    • Hamer, J.1
  • 16
    • 0043039017 scopus 로고
    • H. Gotthardt and R. Huisgen, Chem. Ber., 103 (1970) 2625. R. Huisgen, H, Gotthardt, H.O. Bayer and F.C. Schaefer, Chem. Ber., 103 (1970) 2611.
    • (1970) Chem. Ber. , vol.103 , pp. 2625
    • Gotthardt, H.1    Huisgen, R.2
  • 20
    • 0002502831 scopus 로고
    • G.M. Priestly and R.N. Warrener, Tetrahedron Lett., (1972) 4295. P.S. Anderson, M.E. Christly, E.L. Engelhardt, G.F. Lundell and G.S. Ponticello, J. Heterocycl. Chem., 14 (1977) 213.
    • (1972) Tetrahedron Lett. , pp. 4295
    • Priestly, G.M.1    Warrener, R.N.2
  • 22
    • 0009371139 scopus 로고
    • Indiana University, Bloomington, IN
    • J.J.P. Stewart, MOPAC, QCPE No. 455, Indiana University, Bloomington, IN, 1983.
    • (1983) MOPAC, QCPE , vol.455
    • Stewart, J.J.P.1
  • 25
    • 0003442182 scopus 로고
    • Springer-Verlag, New York
    • J.K. Labanowski and J.W. Andzelm, Density Functional Methods in Chemistry, Springer-Verlag, New York, 1991. G.J. Laming, V. Termath and N.C. Handy, J. Chem. Phys., 99 (1993) 8765. A.D. Becke, J. Chem. Phys., 98 (1993) 5648. J. Andzelm and E. Wimmer, J. Chem. Phys., 96 (1992) 1280. L. Fan and T. Ziegler, J. Am. Chem. Soc., 114 (1992) 10890. T. Ziegler, Chem. Rev., 91 (1992) 651. C. Sosa and C. Lee, J. Chem. Phys., 98 (1993) 8004.
    • (1991) Density Functional Methods in Chemistry
    • Labanowski, J.K.1    Andzelm, J.W.2
  • 26
    • 0000467832 scopus 로고
    • J.K. Labanowski and J.W. Andzelm, Density Functional Methods in Chemistry, Springer-Verlag, New York, 1991. G.J. Laming, V. Termath and N.C. Handy, J. Chem. Phys., 99 (1993) 8765. A.D. Becke, J. Chem. Phys., 98 (1993) 5648. J. Andzelm and E. Wimmer, J. Chem. Phys., 96 (1992) 1280. L. Fan and T. Ziegler, J. Am. Chem. Soc., 114 (1992) 10890. T. Ziegler, Chem. Rev., 91 (1992) 651. C. Sosa and C. Lee, J. Chem. Phys., 98 (1993) 8004.
    • (1993) J. Chem. Phys. , vol.99 , pp. 8765
    • Laming, G.J.1    Termath, V.2    Handy, N.C.3
  • 27
    • 0000189651 scopus 로고
    • J.K. Labanowski and J.W. Andzelm, Density Functional Methods in Chemistry, Springer-Verlag, New York, 1991. G.J. Laming, V. Termath and N.C. Handy, J. Chem. Phys., 99 (1993) 8765. A.D. Becke, J. Chem. Phys., 98 (1993) 5648. J. Andzelm and E. Wimmer, J. Chem. Phys., 96 (1992) 1280. L. Fan and T. Ziegler, J. Am. Chem. Soc., 114 (1992) 10890. T. Ziegler, Chem. Rev., 91 (1992) 651. C. Sosa and C. Lee, J. Chem. Phys., 98 (1993) 8004.
    • (1993) J. Chem. Phys. , vol.98 , pp. 5648
    • Becke, A.D.1
  • 28
    • 3342922190 scopus 로고
    • J.K. Labanowski and J.W. Andzelm, Density Functional Methods in Chemistry, Springer-Verlag, New York, 1991. G.J. Laming, V. Termath and N.C. Handy, J. Chem. Phys., 99 (1993) 8765. A.D. Becke, J. Chem. Phys., 98 (1993) 5648. J. Andzelm and E. Wimmer, J. Chem. Phys., 96 (1992) 1280. L. Fan and T. Ziegler, J. Am. Chem. Soc., 114 (1992) 10890. T. Ziegler, Chem. Rev., 91 (1992) 651. C. Sosa and C. Lee, J. Chem. Phys., 98 (1993) 8004.
    • (1992) J. Chem. Phys. , vol.96 , pp. 1280
    • Andzelm, J.1    Wimmer, E.2
  • 29
    • 0642364764 scopus 로고
    • J.K. Labanowski and J.W. Andzelm, Density Functional Methods in Chemistry, Springer-Verlag, New York, 1991. G.J. Laming, V. Termath and N.C. Handy, J. Chem. Phys., 99 (1993) 8765. A.D. Becke, J. Chem. Phys., 98 (1993) 5648. J. Andzelm and E. Wimmer, J. Chem. Phys., 96 (1992) 1280. L. Fan and T. Ziegler, J. Am. Chem. Soc., 114 (1992) 10890. T. Ziegler, Chem. Rev., 91 (1992) 651. C. Sosa and C. Lee, J. Chem. Phys., 98 (1993) 8004.
    • (1992) J. Am. Chem. Soc. , vol.114 , pp. 10890
    • Fan, L.1    Ziegler, T.2
  • 30
    • 0344791553 scopus 로고
    • J.K. Labanowski and J.W. Andzelm, Density Functional Methods in Chemistry, Springer-Verlag, New York, 1991. G.J. Laming, V. Termath and N.C. Handy, J. Chem. Phys., 99 (1993) 8765. A.D. Becke, J. Chem. Phys., 98 (1993) 5648. J. Andzelm and E. Wimmer, J. Chem. Phys., 96 (1992) 1280. L. Fan and T. Ziegler, J. Am. Chem. Soc., 114 (1992) 10890. T. Ziegler, Chem. Rev., 91 (1992) 651. C. Sosa and C. Lee, J. Chem. Phys., 98 (1993) 8004.
    • (1992) Chem. Rev. , vol.91 , pp. 651
    • Ziegler, T.1
  • 31
    • 5544227187 scopus 로고
    • J.K. Labanowski and J.W. Andzelm, Density Functional Methods in Chemistry, Springer-Verlag, New York, 1991. G.J. Laming, V. Termath and N.C. Handy, J. Chem. Phys., 99 (1993) 8765. A.D. Becke, J. Chem. Phys., 98 (1993) 5648. J. Andzelm and E. Wimmer, J. Chem. Phys., 96 (1992) 1280. L. Fan and T. Ziegler, J. Am. Chem. Soc., 114 (1992) 10890. T. Ziegler, Chem. Rev., 91 (1992) 651. C. Sosa and C. Lee, J. Chem. Phys., 98 (1993) 8004.
    • (1993) J. Chem. Phys. , vol.98 , pp. 8004
    • Sosa, C.1    Lee, C.2
  • 35
    • 85022583881 scopus 로고
    • W.J. Hehre, R. Ditchfield and J.A. Pople, J. Chem. Phys., 56 (1972) 2257. M.S. Gordon, Chem. Phys. Lett., 76 (1980) 163.
    • (1980) Chem. Phys. Lett. , vol.76 , pp. 163
    • Gordon, M.S.1
  • 36
    • 0042936582 scopus 로고
    • W.J. Albery, Adv. Phys. Org. Chem., 28 (1993) 139. R.A. Marcus, Science, 256 (1992) 1523. I.W.M. Smith, Nature, 358 (1992) 279.
    • (1993) Adv. Phys. Org. Chem. , vol.28 , pp. 139
    • Albery, W.J.1
  • 37
    • 0001641332 scopus 로고
    • W.J. Albery, Adv. Phys. Org. Chem., 28 (1993) 139. R.A. Marcus, Science, 256 (1992) 1523. I.W.M. Smith, Nature, 358 (1992) 279.
    • (1992) Science , vol.256 , pp. 1523
    • Marcus, R.A.1
  • 38
    • 0027125765 scopus 로고
    • W.J. Albery, Adv. Phys. Org. Chem., 28 (1993) 139. R.A. Marcus, Science, 256 (1992) 1523. I.W.M. Smith, Nature, 358 (1992) 279.
    • (1992) Nature , vol.358 , pp. 279
    • Smith, I.W.M.1
  • 40
    • 0001347948 scopus 로고
    • and references cited therein
    • M.J. Dewar and C. Jie, Acc. Chem. Res., 25 (1992) 537, and references cited therein. K.N. Houk, Y. Lin and J.D. Evansek, Angew. Chem., Int. Ed. Engl., 31 (1992) 682. K.H. Houk, J. Gonzalez and Y. Li, Acc. Chem. Res., 28 (1995) 81, and references cited therein.
    • (1992) Acc. Chem. Res. , vol.25 , pp. 537
    • Dewar, M.J.1    Jie, C.2
  • 41
    • 33748960439 scopus 로고
    • M.J. Dewar and C. Jie, Acc. Chem. Res., 25 (1992) 537, and references cited therein. K.N. Houk, Y. Lin and J.D. Evansek, Angew. Chem., Int. Ed. Engl., 31 (1992) 682. K.H. Houk, J. Gonzalez and Y. Li, Acc. Chem. Res., 28 (1995) 81, and references cited therein.
    • (1992) Angew. Chem., Int. Ed. Engl. , vol.31 , pp. 682
    • Houk, K.N.1    Lin, Y.2    Evansek, J.D.3
  • 42
    • 0002549529 scopus 로고
    • and references cited therein
    • M.J. Dewar and C. Jie, Acc. Chem. Res., 25 (1992) 537, and references cited therein. K.N. Houk, Y. Lin and J.D. Evansek, Angew. Chem., Int. Ed. Engl., 31 (1992) 682. K.H. Houk, J. Gonzalez and Y. Li, Acc. Chem. Res., 28 (1995) 81, and references cited therein.
    • (1995) Acc. Chem. Res. , vol.28 , pp. 81
    • Houk, K.H.1    Gonzalez, J.2    Li, Y.3
  • 44
    • 0000631352 scopus 로고
    • F. Bernardi, A. Bottoni, M.J. Field, M.F. Guest, I.H. Hillier, M.A. Robb and A. Venturini, J. Am. Chem. Soc., 110 (1988) 3050. K.N. Houk and Y. Li, J. Am. Chem. Soc., 115 (1993) 7478.
    • (1993) J. Am. Chem. Soc. , vol.115 , pp. 7478
    • Houk, K.N.1    Li, Y.2
  • 45
    • 85034916948 scopus 로고
    • R.V. Stantona and K.M. Merz, Jr., J. Chem. Phys., 100 (1994) 434. J.E. Carpenter and C. Sosa, J. Mol. Struct. (Theochem), 117 (1994) 325.
    • (1994) J. Chem. Phys. , vol.100 , pp. 434
    • Stantona, R.V.1    K.m M., Jr.2
  • 51
    • 0043039015 scopus 로고    scopus 로고
    • in preparation
    • B.S. Jursic, in preparation.
    • Jursic, B.S.1
  • 52
    • 84987055346 scopus 로고
    • B.S. Jursic and Z. Zdravkovski, Int. J. Quantum Chem., 54 (1995) 161. B.S. Jursic, Int. J. Quantum Chem., 57 (1996) 213. B.S. Jursic, Chem. Phys. Lett., 236 (1995) 206. B.S. Jursic, J. Comput. Chem., 17 (1996) 835. B.S. Jursic, J. Mol. Struct. (Theochem), 358 (1996) 145.
    • (1995) Int. J. Quantum Chem. , vol.54 , pp. 161
    • Jursic, B.S.1    Zdravkovski, Z.2
  • 53
    • 0002822866 scopus 로고    scopus 로고
    • B.S. Jursic and Z. Zdravkovski, Int. J. Quantum Chem., 54 (1995) 161. B.S. Jursic, Int. J. Quantum Chem., 57 (1996) 213. B.S. Jursic, Chem. Phys. Lett., 236 (1995) 206. B.S. Jursic, J. Comput. Chem., 17 (1996) 835. B.S. Jursic, J. Mol. Struct. (Theochem), 358 (1996) 145.
    • (1996) Int. J. Quantum Chem. , vol.57 , pp. 213
    • Jursic, B.S.1
  • 54
    • 24444463226 scopus 로고
    • B.S. Jursic and Z. Zdravkovski, Int. J. Quantum Chem., 54 (1995) 161. B.S. Jursic, Int. J. Quantum Chem., 57 (1996) 213. B.S. Jursic, Chem. Phys. Lett., 236 (1995) 206. B.S. Jursic, J. Comput. Chem., 17 (1996) 835. B.S. Jursic, J. Mol. Struct. (Theochem), 358 (1996) 145.
    • (1995) Chem. Phys. Lett. , vol.236 , pp. 206
    • Jursic, B.S.1
  • 55
    • 0005396984 scopus 로고    scopus 로고
    • B.S. Jursic and Z. Zdravkovski, Int. J. Quantum Chem., 54 (1995) 161. B.S. Jursic, Int. J. Quantum Chem., 57 (1996) 213. B.S. Jursic, Chem. Phys. Lett., 236 (1995) 206. B.S. Jursic, J. Comput. Chem., 17 (1996) 835. B.S. Jursic, J. Mol. Struct. (Theochem), 358 (1996) 145.
    • (1996) J. Comput. Chem. , vol.17 , pp. 835
    • Jursic, B.S.1
  • 56
    • 0041936228 scopus 로고    scopus 로고
    • B.S. Jursic and Z. Zdravkovski, Int. J. Quantum Chem., 54 (1995) 161. B.S. Jursic, Int. J. Quantum Chem., 57 (1996) 213. B.S. Jursic, Chem. Phys. Lett., 236 (1995) 206. B.S. Jursic, J. Comput. Chem., 17 (1996) 835. B.S. Jursic, J. Mol. Struct. (Theochem), 358 (1996) 145.
    • (1996) J. Mol. Struct. (Theochem) , vol.358 , pp. 145
    • Jursic, B.S.1
  • 57
    • 0000782133 scopus 로고    scopus 로고
    • B.S. Jursic, J. Mol. Struct. (Theochem), 358 (1996) 139. B.S. Jursic, J. Mol. Struct. (Theochem), 365 (1996) 55. B.S. Jursic and B. LeBlanc, J. Heterocyclic Chem., 33 (1996) 1389.
    • (1996) J. Mol. Struct. (Theochem) , vol.358 , pp. 139
    • Jursic, B.S.1
  • 58
    • 0004769909 scopus 로고    scopus 로고
    • B.S. Jursic, J. Mol. Struct. (Theochem), 358 (1996) 139. B.S. Jursic, J. Mol. Struct. (Theochem), 365 (1996) 55. B.S. Jursic and B. LeBlanc, J. Heterocyclic Chem., 33 (1996) 1389.
    • (1996) J. Mol. Struct. (Theochem) , vol.365 , pp. 55
    • Jursic, B.S.1
  • 59
    • 0043220218 scopus 로고    scopus 로고
    • B.S. Jursic, J. Mol. Struct. (Theochem), 358 (1996) 139. B.S. Jursic, J. Mol. Struct. (Theochem), 365 (1996) 55. B.S. Jursic and B. LeBlanc, J. Heterocyclic Chem., 33 (1996) 1389.
    • (1996) J. Heterocyclic Chem. , vol.33 , pp. 1389
    • Jursic, B.S.1    LeBlanc, B.2
  • 61
    • 0001866831 scopus 로고
    • B.S. Jursic and Z. Zdravkovski, J. Mol. Struct. (Theochem), 332 (1995) 39. B.S. Jursic and Z. Zdravkovski, J. Phys. Org. Chem., 7 (1994) 634, 641. B.S. Jursic and Z. Zdravkovski, J. Heterocycl. Chem., 31 (1994) 1429. B.S. Jursic and Z. Zdravkovski, J. Chem. Soc., Perkin Trans. 2 (1994) 1877. B.S. Jursic and Z. Zdravkovski, J. Mol. Struct. (Theochem), 315 (1994) 85. B.S. Jursic and Z. Zdravkovski, Bull. Chem. Technol. Macedonia, 13 (1994) 55.
    • (1995) J. Mol. Struct. (Theochem) , vol.332 , pp. 39
    • Jursic, B.S.1    Zdravkovski, Z.2
  • 62
    • 84985463861 scopus 로고
    • B.S. Jursic and Z. Zdravkovski, J. Mol. Struct. (Theochem), 332 (1995) 39. B.S. Jursic and Z. Zdravkovski, J. Phys. Org. Chem., 7 (1994) 634, 641. B.S. Jursic and Z. Zdravkovski, J. Heterocycl. Chem., 31 (1994) 1429. B.S. Jursic and Z. Zdravkovski, J. Chem. Soc., Perkin Trans. 2 (1994) 1877. B.S. Jursic and Z. Zdravkovski, J. Mol. Struct. (Theochem), 315 (1994) 85. B.S. Jursic and Z. Zdravkovski, Bull. Chem. Technol. Macedonia, 13 (1994) 55.
    • (1994) J. Phys. Org. Chem. , vol.7 , pp. 634
    • Jursic, B.S.1    Zdravkovski, Z.2
  • 63
    • 84993845934 scopus 로고
    • B.S. Jursic and Z. Zdravkovski, J. Mol. Struct. (Theochem), 332 (1995) 39. B.S. Jursic and Z. Zdravkovski, J. Phys. Org. Chem., 7 (1994) 634, 641. B.S. Jursic and Z. Zdravkovski, J. Heterocycl. Chem., 31 (1994) 1429. B.S. Jursic and Z. Zdravkovski, J. Chem. Soc., Perkin Trans. 2 (1994) 1877. B.S. Jursic and Z. Zdravkovski, J. Mol. Struct. (Theochem), 315 (1994) 85. B.S. Jursic and Z. Zdravkovski, Bull. Chem. Technol. Macedonia, 13 (1994) 55.
    • (1994) J. Heterocycl. Chem. , vol.31 , pp. 1429
    • Jursic, B.S.1    Zdravkovski, Z.2
  • 64
    • 34248143205 scopus 로고
    • B.S. Jursic and Z. Zdravkovski, J. Mol. Struct. (Theochem), 332 (1995) 39. B.S. Jursic and Z. Zdravkovski, J. Phys. Org. Chem., 7 (1994) 634, 641. B.S. Jursic and Z. Zdravkovski, J. Heterocycl. Chem., 31 (1994) 1429. B.S. Jursic and Z. Zdravkovski, J. Chem. Soc., Perkin Trans. 2 (1994) 1877. B.S. Jursic and Z. Zdravkovski, J. Mol. Struct. (Theochem), 315 (1994) 85. B.S. Jursic and Z. Zdravkovski, Bull. Chem. Technol. Macedonia, 13 (1994) 55.
    • (1994) J. Chem. Soc., Perkin Trans. , vol.2 , pp. 1877
    • Jursic, B.S.1    Zdravkovski, Z.2
  • 65
    • 0006234031 scopus 로고
    • B.S. Jursic and Z. Zdravkovski, J. Mol. Struct. (Theochem), 332 (1995) 39. B.S. Jursic and Z. Zdravkovski, J. Phys. Org. Chem., 7 (1994) 634, 641. B.S. Jursic and Z. Zdravkovski, J. Heterocycl. Chem., 31 (1994) 1429. B.S. Jursic and Z. Zdravkovski, J. Chem. Soc., Perkin Trans. 2 (1994) 1877. B.S. Jursic and Z. Zdravkovski, J. Mol. Struct. (Theochem), 315 (1994) 85. B.S. Jursic and Z. Zdravkovski, Bull. Chem. Technol. Macedonia, 13 (1994) 55.
    • (1994) J. Mol. Struct. (Theochem) , vol.315 , pp. 85
    • Jursic, B.S.1    Zdravkovski, Z.2
  • 66
    • 0041614998 scopus 로고
    • B.S. Jursic and Z. Zdravkovski, J. Mol. Struct. (Theochem), 332 (1995) 39. B.S. Jursic and Z. Zdravkovski, J. Phys. Org. Chem., 7 (1994) 634, 641. B.S. Jursic and Z. Zdravkovski, J. Heterocycl. Chem., 31 (1994) 1429. B.S. Jursic and Z. Zdravkovski, J. Chem. Soc., Perkin Trans. 2 (1994) 1877. B.S. Jursic and Z. Zdravkovski, J. Mol. Struct. (Theochem), 315 (1994) 85. B.S. Jursic and Z. Zdravkovski, Bull. Chem. Technol. Macedonia, 13 (1994) 55.
    • (1994) Bull. Chem. Technol. Macedonia , vol.13 , pp. 55
    • Jursic, B.S.1    Zdravkovski, Z.2
  • 67
    • 0000262607 scopus 로고
    • G.S. Hammond, J. Am. Chem. Soc., 77 (1955) 344. For analytical functions that describe the reaction coordinates and reproduce the Hammond behavior see: W.J. Noble, A.R. Miller and S.D. Hermann, J. Org. Chem., 42 (1977) 338. A.R. Miller, J. Am. Chem. Soc., 100 (1978) 1984.
    • (1955) J. Am. Chem. Soc. , vol.77 , pp. 344
    • Hammond, G.S.1
  • 68
    • 0000586846 scopus 로고
    • G.S. Hammond, J. Am. Chem. Soc., 77 (1955) 344. For analytical functions that describe the reaction coordinates and reproduce the Hammond behavior see: W.J. Noble, A.R. Miller and S.D. Hermann, J. Org. Chem., 42 (1977) 338. A.R. Miller, J. Am. Chem. Soc., 100 (1978) 1984.
    • (1977) J. Org. Chem. , vol.42 , pp. 338
    • Noble, W.J.1    Miller, A.R.2    Hermann, S.D.3
  • 69
    • 0001518120 scopus 로고
    • G.S. Hammond, J. Am. Chem. Soc., 77 (1955) 344. For analytical functions that describe the reaction coordinates and reproduce the Hammond behavior see: W.J. Noble, A.R. Miller and S.D. Hermann, J. Org. Chem., 42 (1977) 338. A.R. Miller, J. Am. Chem. Soc., 100 (1978) 1984.
    • (1978) J. Am. Chem. Soc. , vol.100 , pp. 1984
    • Miller, A.R.1
  • 71
    • 0041717716 scopus 로고
    • B.G. Johnson, C.A. Gonzalez, P.M.W. Gill and J.A. Pople, Chem. Phys. Lett., 221 (1994) 100. J. Baker, J. Andzelm, M. Muir and P.R. Taylor, Chem. Phys. Lett., 237 (1995) 531. B.S. Jursic, Chem. Phys. Lett., 256 (1996) 603.
    • (1995) Chem. Phys. Lett. , vol.237 , pp. 531
    • Baker, J.1    Andzelm, J.2    Muir, M.3    Taylor, P.R.4
  • 72
    • 0030581027 scopus 로고    scopus 로고
    • B.G. Johnson, C.A. Gonzalez, P.M.W. Gill and J.A. Pople, Chem. Phys. Lett., 221 (1994) 100. J. Baker, J. Andzelm, M. Muir and P.R. Taylor, Chem. Phys. Lett., 237 (1995) 531. B.S. Jursic, Chem. Phys. Lett., 256 (1996) 603.
    • (1996) Chem. Phys. Lett. , vol.256 , pp. 603
    • Jursic, B.S.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.