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Cativiela, C.1
García, J.I.2
Mayoral, J.A.3
Salvatella, L.4
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6
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2342636982
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Qian, J.; Timko, M. T.; Allen, A. J.; Russell, C.; Winnik, B.; Buckley, B.; Steinfeld, J. I.; Tester, J. W. J. Am. Chem. Soc. 2004, 126, 5465-5474.
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Qian, J.1
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Winnik, B.5
Buckley, B.6
Steinfeld, J.I.7
Tester, J.W.8
-
7
-
-
13844310593
-
-
note
-
This theory was suggested in a footnote in the article by Breslow (ref 1).
-
-
-
-
8
-
-
0001538756
-
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(a) Fisher, M. J.; Hehre, W. J.; Kahn, S. D.; Overman, L. E. J. Am. Chem. Soc. 1988, 110, 4625-4633.
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Fisher, M.J.1
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Overman, L.E.4
-
10
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0001262036
-
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(c) Datta, S. C.; Franck, R. W.; Tripathy, R.; Quigley, G. J.; Huang, L.; Chen, S.; Sihaed, A. J. Am. Chem. Soc. 1990, 112, 8472-8478.
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Datta, S.C.1
Franck, R.W.2
Tripathy, R.3
Quigley, G.J.4
Huang, L.5
Chen, S.6
Sihaed, A.7
-
11
-
-
17444363263
-
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(d) Hatakeyama, S.; Sugawara, K.; Takano, S. J. Chem. Soc., Chem. Commun. 1992, 953-955.
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Hatakeyama, S.1
Sugawara, K.2
Takano, S.3
-
14
-
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0001345306
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Tripathy, R.; Carroll, P. J.; Thornton, E. R. J. Am. Chem. Soc. 1991, 113, 7630-7640.
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Tripathy, R.1
Carroll, P.J.2
Thornton, E.R.3
-
15
-
-
21044458904
-
-
1/2) were taken from the following sources. Non-hydrogen-bonding solvents: (a) Abboud, J.-L. M.; Notario, R. Pure Appl. Chem. 1989, 71, 645-718. HBD solvents: (b) Marcus, Y. The Properties of Solvents; Wiley: Chichester, UK, 1998. FC-75: (c) Ref 4.
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-
Abboud, J.-L.M.1
Notario, R.2
-
16
-
-
0004219659
-
-
Wiley: Chichester, UK
-
1/2) were taken from the following sources. Non-hydrogen-bonding solvents: (a) Abboud, J.-L. M.; Notario, R. Pure Appl. Chem. 1989, 71, 645-718. HBD solvents: (b) Marcus, Y. The Properties of Solvents; Wiley: Chichester, UK, 1998. FC-75: (c) Ref 4.
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(1998)
The Properties of Solvents
-
-
Marcus, Y.1
-
17
-
-
13844307471
-
-
Ref 4
-
1/2) were taken from the following sources. Non-hydrogen-bonding solvents: (a) Abboud, J.-L. M.; Notario, R. Pure Appl. Chem. 1989, 71, 645-718. HBD solvents: (b) Marcus, Y. The Properties of Solvents; Wiley: Chichester, UK, 1998. FC-75: (c) Ref 4.
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-
-
-
18
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0942299119
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Katritzky, A. R.; Fara, D. C.; Yang, H.; Tämm, K. Chem. Rev. 2004, 104, 175-198.
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Katritzky, A.R.1
Fara, D.C.2
Yang, H.3
Tämm, K.4
-
19
-
-
0041573625
-
-
π* values (in MPa) of hydrogen-bonding solvents were taken from: (a) Kamlet, M. J.; Abboud, J.-L. M.; Abraham, M. H.; Taft, R. W. J. Org. Chem. 1983, 48, 2877-2887. For non-hydrogen-bonding solvents, π* values were taken from: (b) Laurence, C.; Nicolet, P.; Dalati, M. T.; Abboud, J.-L. M.; Notario, R. J. Phys. Chem. 1994, 98, 5807-5816.
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J. Org. Chem.
, vol.48
, pp. 2877-2887
-
-
Kamlet, M.J.1
Abboud, J.-L.M.2
Abraham, M.H.3
Taft, R.W.4
-
20
-
-
33751158711
-
-
π* values (in MPa) of hydrogen-bonding solvents were taken from: (a) Kamlet, M. J.; Abboud, J.-L. M.; Abraham, M. H.; Taft, R. W. J. Org. Chem. 1983, 48, 2877-2887. For non-hydrogen-bonding solvents, π* values were taken from: (b) Laurence, C.; Nicolet, P.; Dalati, M. T.; Abboud, J.-L. M.; Notario, R. J. Phys. Chem. 1994, 98, 5807-5816.
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, vol.98
, pp. 5807-5816
-
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Laurence, C.1
Nicolet, P.2
Dalati, M.T.3
Abboud, J.-L.M.4
Notario, R.5
-
21
-
-
13844314991
-
-
note
-
2 parameters. Therefore, no change in the number of independent parameters is introduced in our model through the replacement of δ by the π* parameter.
-
-
-
-
22
-
-
37049089554
-
-
Large deviation from a linear regression model has also been found for TFE in a study on the regioselectivity of the isoprene + methyl vinyl ketone Diels-Alder reaction. The corresponding IR spectrum allows this result to be attributed to the double hydrogen-bonding coordination of the solvent to the dienophile. Cativiela, C.; García, J. I.; Mayoral, J. A.; Salvatella, J. Chem. Soc., Perkin Trans. 2 1994, 847-851.
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J. Chem. Soc., Perkin Trans. 2
, pp. 847-851
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Cativiela, C.1
García, J.I.2
Mayoral, J.A.3
Salvatella4
-
23
-
-
0027321670
-
-
(a) Cativiela, C.; García, J. I.; Mayoral, J. A.; Royo, A. J.; Salvatella, L. Tetrahedron: Asymm. 1993, 4, 1613-1618.
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Cativiela, C.1
García, J.I.2
Mayoral, J.A.3
Royo, A.J.4
Salvatella, L.5
-
24
-
-
0002370338
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-
(b) Cativiela, C.; García, J. I.; Gil, J.; Martínez, R. M.; Mayoral, J. A.; Salvatella, L.; Urieta, J. S.; Mainar, A. M.; Abraham, M. H. J. Chem. Soc., Perkin Trans. 2 1997, 653-660.
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Cativiela, C.1
García, J.I.2
Gil, J.3
Martínez, R.M.4
Mayoral, J.A.5
Salvatella, L.6
Urieta, J.S.7
Mainar, A.M.8
Abraham, M.H.9
-
25
-
-
84987044789
-
-
Cativiela, C.; García, J. I.; Mayoral, J. A.; Royo, A. J.; Salvatella, L. J. Phys. Org. Chem. 1992, 5, 230-238.
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, vol.5
, pp. 230-238
-
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Cativiela, C.1
García, J.I.2
Mayoral, J.A.3
Royo, A.J.4
Salvatella, L.5
-
28
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-
0001753011
-
-
Breslow, R.; Connors, R.; Zhu, Z. Pure Appl. Chem. 1996, 68, 1527-1533.
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Breslow, R.1
Connors, R.2
Zhu, Z.3
-
29
-
-
0032546235
-
-
Yeung, K.-S.; Meanwell, N. A.; Li, Y.; Gao, Q. Tetrahedron Lett. 1998, 39, 1483-1486.
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Yeung, K.-S.1
Meanwell, N.A.2
Li, Y.3
Gao, Q.4
-
31
-
-
13844316162
-
-
This TS (calculated at the B3LYP/6-31G(d) level) is shown in ref 5
-
This TS (calculated at the B3LYP/6-31G(d) level) is shown in ref 5.
-
-
-
-
33
-
-
13844306034
-
-
-1, respectively
-
-1, respectively.
-
-
-
-
34
-
-
0141704726
-
-
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Mennucci, B.15
Cossi, M.16
Scalmani, G.17
Rega, N.18
Petersson, G.A.19
Nakatsuji, H.20
Hada, M.21
Ehara, M.22
Toyota, K.23
Fukuda, R.24
Hasegawa, J.25
Ishida, M.26
Nakajima, T.27
Honda, Y.28
Kitao, O.29
Nakai, H.30
Klene, M.31
Li, X.32
Knox, J.E.33
Hratchian, H.P.34
Cross, J.B.35
Adamo, C.36
Jaramillo, C.37
Gomperts, R.38
Stratmann, R.E.39
Yazyev, O.40
Austin, A.J.41
Cammi, R.42
Pomelli, C.43
Ochterski, J.W.44
Ayala, P.Y.45
Morokuma, K.46
Voth, G.A.47
Salvador, P.48
Dannenberg, J.J.49
Zakrzewski, V.G.50
Dapprich, S.51
Daniels, A.D.52
Strain, M.C.53
Farkas, O.54
Malick, D.K.55
Rabuck, A.D.56
Raghavachari, K.57
Foresman, J.B.58
Ortiz, J.V.59
Cui, Q.60
Baboul, A.G.61
Clifford, S.62
Cioslowski, J.63
Stefanov, B.B.64
Liu, G.65
Liashenko, A.66
Piskorz, P.67
Komaromi, I.68
Martin, R.L.69
Fox, D.J.70
Keith, T.71
Al-Laham, M.A.72
Peng, C.Y.73
Nanayakkara, A.74
Challacombe, M.75
Gill, P.M.W.76
Johnson, B.77
Chen, W.78
Wong, M.W.79
González, C.80
Pople, J.A.81
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