-
5
-
-
0001031824
-
-
Hodges, R. V.; Sullivan, S. A.; Beauchamp, J. L. J. Am. Chem. Soc. 1980, 102, 935-938.
-
(1980)
J. Am. Chem. Soc.
, vol.102
, pp. 935-938
-
-
Hodges, R.V.1
Sullivan, S.A.2
Beauchamp, J.L.3
-
7
-
-
0011712892
-
-
Asubiojo, O. I.; Brauman, J. I.; Levin, R. H. J. Am. Chem. Soc. 1977, 99, 7707-7708.
-
(1977)
J. Am. Chem. Soc.
, vol.99
, pp. 7707-7708
-
-
Asubiojo, O.I.1
Brauman, J.I.2
Levin, R.H.3
-
9
-
-
0001701066
-
-
Dejaegere, A.; Liang, X.; Karplus, M. J. Chem. Soc., Faraday Trans. 1994, 90, 1763-1770.
-
(1994)
J. Chem. Soc., Faraday Trans.
, vol.90
, pp. 1763-1770
-
-
Dejaegere, A.1
Liang, X.2
Karplus, M.3
-
12
-
-
84961981798
-
-
Bianciotto, M.; Barthelat, J.-C.; Vigroux, A. J. Am. Chem. Soc. 2002, 124, 7573-7587.
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 7573-7587
-
-
Bianciotto, M.1
Barthelat, J.-C.2
Vigroux, A.3
-
17
-
-
0001246466
-
-
Bunton, C. A.; Fendler, E. J.; Pendler, J. H. J. Am. Chem. Soc. 1967, 89, 1221-1230.
-
(1967)
J. Am. Chem. Soc.
, vol.89
, pp. 1221-1230
-
-
Bunton, C.A.1
Fendler, E.J.2
Pendler, J.H.3
-
20
-
-
0000546527
-
-
Friedman, J.; Freeman, S.; Knowles, J. J. Am. Chem. Soc. 1988, 110, 1268-1275.
-
(1988)
J. Am. Chem. Soc.
, vol.110
, pp. 1268-1275
-
-
Friedman, J.1
Freeman, S.2
Knowles, J.3
-
21
-
-
0037015719
-
-
Menegon, G.; Loos, M.; Chaimovich, H. J. Phys. Chem. A 2002, 106, 9078-9084.
-
(2002)
J. Phys. Chem. A
, vol.106
, pp. 9078-9084
-
-
Menegon, G.1
Loos, M.2
Chaimovich, H.3
-
23
-
-
0032508930
-
-
Florián, J.; Áqvist, J.; Warshel, A. J. Am. Chem. Soc. 1998, 120, 11524-11525.
-
(1998)
J. Am. Chem. Soc.
, vol.120
, pp. 11524-11525
-
-
Florián, J.1
Áqvist, J.2
Warshel, A.3
-
24
-
-
0001384360
-
-
Boldyrev, A.; Gutowski, M.; Simons, J. Acc. Chem. Res. 1996, 29, 497-502.
-
(1996)
Acc. Chem. Res.
, vol.29
, pp. 497-502
-
-
Boldyrev, A.1
Gutowski, M.2
Simons, J.3
-
26
-
-
0002769046
-
-
Mercero, J. M.; Barrett, P.; Lam, C. W.; Fowler, J. E.; Ugalde, J. M.; Pedersen, L. G. J. Comput. Chem. 2000, 21, 43-51.
-
(2000)
J. Comput. Chem.
, vol.21
, pp. 43-51
-
-
Mercero, J.M.1
Barrett, P.2
Lam, C.W.3
Fowler, J.E.4
Ugalde, J.M.5
Pedersen, L.G.6
-
30
-
-
0031860103
-
-
Barford, D.; Das, A. K.; Egloff, M. P. Annu. Rev. Biophys. Biomol. Struct. 1998, 27, 133-164.
-
(1998)
Annu. Rev. Biophys. Biomol. Struct.
, vol.27
, pp. 133-164
-
-
Barford, D.1
Das, A.K.2
Egloff, M.P.3
-
31
-
-
36849115659
-
-
Ditchfield, R.; Hehre, W.; Pople, J. A. J. Chem. Phys. 1971, 54, 724-728.
-
(1971)
J. Chem. Phys.
, vol.54
, pp. 724-728
-
-
Ditchfield, R.1
Hehre, W.2
Pople, J.A.3
-
35
-
-
26844534384
-
-
Krishnan, R.; Binkley, J.; Seeger, R.; Pople, J. J. Chem. Phys. 1980, 72, 650-654.
-
(1980)
J. Chem. Phys.
, vol.72
, pp. 650-654
-
-
Krishnan, R.1
Binkley, J.2
Seeger, R.3
Pople, J.4
-
37
-
-
0003422324
-
-
Dover: Ney York
-
Bright Wilson, Jr., E.; Decius, J. C.; Cross, P. C. Molecular Vibrations. The Theory of Infrared and Raman Vibrational Spectra, 1st ed.; Dover: Ney York, 1980.
-
(1980)
Molecular Vibrations. The Theory of Infrared and Raman Vibrational Spectra, 1st Ed.
-
-
Bright Wilson Jr., E.1
Decius, J.C.2
Cross, P.C.3
-
40
-
-
84873055189
-
-
Wiley: New York
-
Hehre, W. J.; Radom, L.; Schleyer, P. R.; Pople, J. A. Ab Initio Molecular Orbital Theory, 1st ed.; Wiley: New York, 1986.
-
(1986)
Ab Initio Molecular Orbital Theory, 1st Ed.
-
-
Hehre, W.J.1
Radom, L.2
Schleyer, P.R.3
Pople, J.A.4
-
44
-
-
0004133516
-
-
revision A.9; Gaussian Inc.: Pittsburgh, PA
-
Frisch, M. J.; et al. Gaussian 98, revision A.9; Gaussian Inc.: Pittsburgh, PA, 1998.
-
(1998)
Gaussian 98
-
-
Frisch, M.J.1
-
45
-
-
26344435738
-
-
Schaefer, A.; Horn, H.; Ahlrichs, R. J. Chem. Phys. 1992, 97, 2571-2577.
-
(1992)
J. Chem. Phys.
, vol.97
, pp. 2571-2577
-
-
Schaefer, A.1
Horn, H.2
Ahlrichs, R.3
-
47
-
-
4243539377
-
-
Ahlrichs, R.; Ber, M.; Hser, M.; Horn, H.; Klmel, C. Chem. Phys. Lett. 1989, 165-169.
-
(1989)
Chem. Phys. Lett.
, pp. 165-169
-
-
Ahlrichs, R.1
Ber, M.2
Hser, M.3
Horn, H.4
Klmel, C.5
-
48
-
-
22744456911
-
-
2004, http://www.dinamicas.art.br/quim/fosf.html.
-
(2004)
-
-
-
50
-
-
0000383584
-
-
Osborn, D.; Leahy, D.; Kim, E.; deBeer, E.; Neumark, D. Chem. Phys. Lett. 1998, 292, 651-655.
-
(1998)
Chem. Phys. Lett.
, vol.292
, pp. 651-655
-
-
Osborn, D.1
Leahy, D.2
Kim, E.3
Debeer, E.4
Neumark, D.5
-
51
-
-
0000759754
-
-
Gunion, R.; Gilles, M.; Polak, M.; Lineberger, W. Int. J. Mass Spectrom. Ion Processes 1992, 117, 601-620.
-
(1992)
Int. J. Mass Spectrom. Ion Processes
, vol.117
, pp. 601-620
-
-
Gunion, R.1
Gilles, M.2
Polak, M.3
Lineberger, W.4
-
52
-
-
0034224244
-
-
Schwartz, R.; Davico, G.; Lineberger, W. J. Electron Spectrosc. Relat. Phenom. 2000, 108, 163-168.
-
(2000)
J. Electron Spectrosc. Relat. Phenom.
, vol.108
, pp. 163-168
-
-
Schwartz, R.1
Davico, G.2
Lineberger, W.3
-
54
-
-
0009780705
-
-
Curtiss, L. A.; Redfern, P. C.; Smith, B. J.; Radom, L. J. Chem. Phys. 1996, 104, 5148-5152.
-
(1996)
J. Chem. Phys.
, vol.104
, pp. 5148-5152
-
-
Curtiss, L.A.1
Redfern, P.C.2
Smith, B.J.3
Radom, L.4
-
56
-
-
0001246313
-
-
Van, Duijneveldt, F. B.; Van, de Rijdt, J. G. C. M.; Van, Lenthe, J. H. Chem. Rev. 1994, 94, 1873-1885.
-
(1994)
Chem. Rev.
, vol.94
, pp. 1873-1885
-
-
Van Duijneveldt, F.B.1
Van De Rijdt, J.G.C.M.2
Van Lenthe, J.H.3
-
58
-
-
0037154845
-
-
Gryzyska, P.; Czyryca, P.; Golithtly, J.; Small, K.; Larsen, P.; Hoff, R.; Hengge, A. J. Org. Chem. 2002, 67, 1214-1220.
-
(2002)
J. Org. Chem.
, vol.67
, pp. 1214-1220
-
-
Gryzyska, P.1
Czyryca, P.2
Golithtly, J.3
Small, K.4
Larsen, P.5
Hoff, R.6
Hengge, A.7
-
59
-
-
0012827693
-
-
Dubourg, A.; Roques, R.; Germain, G.; Declercq, J.; Garrigues, B.; Boyer, D.; Munoz, A.; Klaebe, A.; Comtat, M. J. Chem. Res. (S) 1982, 7, 180-181.
-
(1982)
J. Chem. Res. (S)
, vol.7
, pp. 180-181
-
-
Dubourg, A.1
Roques, R.2
Germain, G.3
Declercq, J.4
Garrigues, B.5
Boyer, D.6
Munoz, A.7
Klaebe, A.8
Comtat, M.9
-
63
-
-
22744436517
-
-
note
-
T of the IMC is not reported.
-
-
-
-
65
-
-
22744434658
-
-
note
-
-1).
-
-
-
-
66
-
-
0033102133
-
-
Áqvist, J.; Kolmodin, K.; Florián, J.; Warshel, A. Chem. Biol. 1999, 6, R71-R80.
-
(1999)
Chem. Biol.
, vol.6
-
-
Áqvist, J.1
Kolmodin, K.2
Florián, J.3
Warshel, A.4
-
68
-
-
85165685874
-
-
George, L.; Sankaran, K.; Viswanathan, K.; Mathews, C. Appl. Spectrosc. 1994, 45, 7-12.
-
(1994)
Appl. Spectrosc.
, vol.45
, pp. 7-12
-
-
George, L.1
Sankaran, K.2
Viswanathan, K.3
Mathews, C.4
-
69
-
-
0030576429
-
-
Vidya, V.; Sankaran, K.; Viswanathan, K. S. Chem. Phys. Lett. 1996, 258, 113-117.
-
(1996)
Chem. Phys. Lett.
, vol.258
, pp. 113-117
-
-
Vidya, V.1
Sankaran, K.2
Viswanathan, K.S.3
-
70
-
-
4243661590
-
-
Ballard, R. E.; Jones, J.; Read, D.; Inchley, A.; Cranmer, M. Chem. Phys. Lett. 1987, 137, 125-129.
-
(1987)
Chem. Phys. Lett.
, vol.137
, pp. 125-129
-
-
Ballard, R.E.1
Jones, J.2
Read, D.3
Inchley, A.4
Cranmer, M.5
-
71
-
-
0003345532
-
-
Nelson, R.; Lide, D.; Maryott, A. Natl. Stand. Ref. Data Ser. 1967, 10, 1.
-
(1967)
Natl. Stand. Ref. Data Ser.
, vol.10
, pp. 1
-
-
Nelson, R.1
Lide, D.2
Maryott, A.3
-
74
-
-
0001998551
-
-
Lias, S.; Bartmess, J.; Liebman, J.; Holmes, J.; Levins, R.; Mallard, W. J. Phys. Chem. Ref. Data 1988, 17, 1-816 (Suppl. 1).
-
(1988)
J. Phys. Chem. Ref. Data
, vol.17
, Issue.1 SUPPL.
, pp. 1-816
-
-
Lias, S.1
Bartmess, J.2
Liebman, J.3
Holmes, J.4
Levins, R.5
Mallard, W.6
-
75
-
-
84944179254
-
-
Harmony, M.; Laurie, V.; Kuczkowski, R.; Schwendeman, R.; Ramsay, D.; Lovas, F.; Lafferty, W.; Maki, A. J. Phys. Chem. Ref. Data 1979, 8, 619-722.
-
(1979)
J. Phys. Chem. Ref. Data
, vol.8
, pp. 619-722
-
-
Harmony, M.1
Laurie, V.2
Kuczkowski, R.3
Schwendeman, R.4
Ramsay, D.5
Lovas, F.6
Lafferty, W.7
Maki, A.8
|