-
1
-
-
0004205694
-
-
Academic Press, New York
-
(a) J. Elguero, A.R. Katritzky, P. Linda, C. Marzin, The Tautomerism of Heterocycles, Academic Press, New York, 1976.
-
(1976)
The Tautomerism of Heterocycles
-
-
Elguero, J.1
Katritzky, A.R.2
Linda, P.3
Marzin, C.4
-
2
-
-
0003275864
-
-
(b) J.S. Kwiatkowski, T.J. Zielinski, R. Rein, Adv. Quantum Chem., 18, 1986, pp. 85.
-
(1986)
Adv. Quantum Chem.
, vol.18
, pp. 85
-
-
Kwiatkowski, J.S.1
Zielinski, T.J.2
Rein, R.3
-
3
-
-
0344269742
-
-
G. Szabo (Ed.), Elsevier, Amsterdam
-
(c) M. Brent, J.S. Kwiatkowski, in: G. Szabo (Ed.), Theoretical Chemistry of Biological Systems, Elsevier, Amsterdam, 1986.
-
(1986)
Theoretical Chemistry of Biological Systems
-
-
Brent, M.1
Kwiatkowski, J.S.2
-
10
-
-
85048649085
-
-
(c) A.F. Ramos, E.C. Lago, J.M. Ramon, E.M. Nunez, A.P. Gallego, J. Mol. Struct. (Theochem) 498 (2000) 191.
-
(2000)
J. Mol. Struct. (Theochem)
, vol.498
, pp. 191
-
-
Ramos, A.F.1
Lago, E.C.2
Ramon, J.M.3
Nunez, E.M.4
Gallego, A.P.5
-
18
-
-
84881454506
-
-
Gaussian, Inc. Pittsburgh, PA
-
GAUSSIAN 98 (Revision A.6), M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, V.G. Zakrzewski, J.A. Montgomery, Jr. R.E. Stratmann, J.C. Burant, S. Dapprich, J.M. Millam, A.D. Daniels, K.N. Kudin, M.C. Strain, O. Farkas, J. Tomasi, V. Barone, M. Cossi, R. Cammi, B. Mennucci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G.A. Petersson, P.Y. Ayala, Q. Cui, K. Morokuma, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J. Cioslowski, J.V. Ortiz, A.G. Baboul, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. Gomperts, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, C. Gonzalez, M. Challacombe, P.M.W. Gill, B.G. Johnson, W. Chen, M.W. Wong, J.L. Andres, M. Head-Gordon, E.S. Replogle, J.A. Pople, Gaussian, Inc. Pittsburgh, PA 1998.
-
(1998)
GAUSSIAN 98 (Revision A.6)
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Zakrzewski, V.G.7
Montgomery Jr., J.A.8
Stratmann, R.E.9
Burant, J.C.10
Dapprich, S.11
Millam, J.M.12
Daniels, A.D.13
Kudin, K.N.14
Strain, M.C.15
Farkas, O.16
Tomasi, J.17
Barone, V.18
Cossi, M.19
Cammi, R.20
Mennucci, B.21
Pomelli, C.22
Adamo, C.23
Clifford, S.24
Ochterski, J.25
Petersson, G.A.26
Ayala, P.Y.27
Cui, Q.28
Morokuma, K.29
Malick, D.K.30
Rabuck, A.D.31
Raghavachari, K.32
Foresman, J.B.33
Cioslowski, J.34
Ortiz, J.V.35
Baboul, A.G.36
Stefanov, B.B.37
Liu, G.38
Liashenko, A.39
Piskorz, P.40
Komaromi, I.41
Gomperts, R.42
Martin, R.L.43
Fox, D.J.44
Keith, T.45
Al-Laham, M.A.46
Peng, C.Y.47
Nanayakkara, A.48
Gonzalez, C.49
Challacombe, M.50
Gill, P.M.W.51
Johnson, B.G.52
Chen, W.53
Wong, M.W.54
Andres, J.L.55
Head-Gordon, M.56
Replogle, E.S.57
Pople, J.A.58
more..
-
21
-
-
1542356431
-
-
(c) J.B. Foresman, T.A. Keith, K.B. Wiberg, J. Snoonian, M.J. Frisch, J. Chem. Phys. 100 (1996) 16098.
-
(1996)
J. Chem. Phys.
, vol.100
, pp. 16098
-
-
Foresman, J.B.1
Keith, T.A.2
Wiberg, K.B.3
Snoonian, J.4
Frisch, M.J.5
-
25
-
-
0000978794
-
-
(a) K.B. Wiberg, P.R. Rablen, D.J. Rush, T.A. Keith, J. Am. Chem. Soc. 117 (1995) 4261.
-
(1995)
J. Am. Chem. Soc.
, vol.117
, pp. 4261
-
-
Wiberg, K.B.1
Rablen, P.R.2
Rush, D.J.3
Keith, T.A.4
-
28
-
-
85030928818
-
-
For detailed calculation results refer to supplementary materials at: http://www.brandonu.ca/Chemistry/people.html#7.
-
-
-
|