-
3
-
-
35748933836
-
-
Vincent, K. A., Parkin, A., and Armstrong, F. A. Chem. Rev. 2007, 107, 4366-4413
-
(2007)
Chem. Rev.
, vol.107
, pp. 4366-4413
-
-
Vincent, K.A.1
Parkin, A.2
Armstrong, F.A.3
-
4
-
-
0040070502
-
-
Yachandra, V. K., Sauer, K., and Klein, M. P. Chem. Rev. 1996, 96, 2927-2950
-
(1996)
Chem. Rev.
, vol.96
, pp. 2927-2950
-
-
Yachandra, V.K.1
Sauer, K.2
Klein, M.P.3
-
12
-
-
49149122068
-
-
Evans, D. H. Chem. Rev. 2008, 108, 2113-2144
-
(2008)
Chem. Rev.
, vol.108
, pp. 2113-2144
-
-
Evans, D.H.1
-
15
-
-
77952116937
-
-
Long, E. C. and Baldwin, M. J., Eds.; American Chemical Society: Washington, DC
-
Schultz, F. A., Lord, R. L., Yang, X., and Baik, M.-H. In ACS Symposium Series; Long, E. C. and Baldwin, M. J., Eds.; American Chemical Society: Washington, DC, 2009; Vol. 1012, pp 151-166.
-
(2009)
ACS Symposium Series
, vol.1012
, pp. 151-166
-
-
Schultz, F.A.1
Lord, R.L.2
Yang, X.3
Baik, M.-H.4
-
16
-
-
0001183852
-
-
Smith, D. A., Zhuang, B., Newton, W. E., McDonald, J. W., and Schultz, F. A. Inorg. Chem. 1987, 26, 2524-2531
-
(1987)
Inorg. Chem.
, vol.26
, pp. 2524-2531
-
-
Smith, D.A.1
Zhuang, B.2
Newton, W.E.3
McDonald, J.W.4
Schultz, F.A.5
-
17
-
-
0026096660
-
-
Fernandes, J. B., Zhang, L. Q., and Schultz, F. A. J. Electroanal. Chem. 1991, 297, 145-161
-
(1991)
J. Electroanal. Chem.
, vol.297
, pp. 145-161
-
-
Fernandes, J.B.1
Zhang, L.Q.2
Schultz, F.A.3
-
18
-
-
0011878431
-
-
Hill, M. G., Rosenhein, L. D., Mann, K. R., Mu, X. H., and Schultz, F. A. Inorg. Chem. 1992, 31, 4108-4111
-
(1992)
Inorg. Chem.
, vol.31
, pp. 4108-4111
-
-
Hill, M.G.1
Rosenhein, L.D.2
Mann, K.R.3
Mu, X.H.4
Schultz, F.A.5
-
20
-
-
33947338018
-
-
Dessy, R. E., Weissman, P. M., and Pohl, R. L. J. Am. Chem. Soc. 1966, 88, 5117-5121
-
(1966)
J. Am. Chem. Soc.
, vol.88
, pp. 5117-5121
-
-
Dessy, R.E.1
Weissman, P.M.2
Pohl, R.L.3
-
21
-
-
33947302728
-
-
Dessy, R. E., Kornmann, R. L., Smith, C., and Haytor, R. J. Am. Chem. Soc. 1968, 90, 2001-2004
-
(1968)
J. Am. Chem. Soc.
, vol.90
, pp. 2001-2004
-
-
Dessy, R.E.1
Kornmann, R.L.2
Smith, C.3
Haytor, R.4
-
22
-
-
0040658863
-
-
Dessy, R. E., Rheingold, A. L., and Howard, G. D. J. Am. Chem. Soc. 1972, 94, 746-752
-
(1972)
J. Am. Chem. Soc.
, vol.94
, pp. 746-752
-
-
Dessy, R.E.1
Rheingold, A.L.2
Howard, G.D.3
-
24
-
-
0000095220
-
-
Ginsburg, R. E., Rothrock, R. K., Finke, R. G., Collman, J. P., and Dahl, L. F. J. Am. Chem. Soc. 1979, 101, 6550-6562
-
(1979)
J. Am. Chem. Soc.
, vol.101
, pp. 6550-6562
-
-
Ginsburg, R.E.1
Rothrock, R.K.2
Finke, R.G.3
Collman, J.P.4
Dahl, L.F.5
-
26
-
-
0001407666
-
-
Collman, J. P., Rothrock, R. K., Finke, R. G., Moore, E. J., and Rose-Munch, F. Inorg. Chem. 1982, 21, 146-156
-
(1982)
Inorg. Chem.
, vol.21
, pp. 146-156
-
-
Collman, J.P.1
Rothrock, R.K.2
Finke, R.G.3
Moore, E.J.4
Rose-Munch, F.5
-
27
-
-
37049071179
-
-
Darchen, A., Mousser, H., and Patin, H. J. Chem. Soc., Chem. Commun. 1988, 968-970
-
(1988)
J. Chem. Soc., Chem. Commun.
, pp. 968-970
-
-
Darchen, A.1
Mousser, H.2
Patin, H.3
-
28
-
-
0011833187
-
-
DiMaio, A. J., Rheingold, A. L., Chin, T. T., Pierce, D. T., and Geiger, W. E. Organometallics 1998, 17, 1169-1176
-
(1998)
Organometallics
, vol.17
, pp. 1169-1176
-
-
Dimaio, A.J.1
Rheingold, A.L.2
Chin, T.T.3
Pierce, D.T.4
Geiger, W.E.5
-
29
-
-
0011564188
-
-
Courtot-Coupez, J., Guéguen, M., Guerchais, J. E., Pétillon, F. Y., Talarmin, J., and Mercier, R. J. Organomet. Chem. 1986, 312, 81-95
-
(1986)
J. Organomet. Chem.
, vol.312
, pp. 81-95
-
-
Courtot-Coupez, J.1
Guéguen, M.2
Guerchais, J.E.3
Pétillon, F.Y.4
Talarmin, J.5
Mercier, R.6
-
30
-
-
0001606138
-
-
El Khalifa, M., Gueguen, M., Mercier, R., Petillon, F. Y., Saillard, J. Y., and Talarmin, J. Organometallics 1989, 8, 140-148
-
(1989)
Organometallics
, vol.8
, pp. 140-148
-
-
El Khalifa, M.1
Gueguen, M.2
Mercier, R.3
Petillon, F.Y.4
Saillard, J.Y.5
Talarmin, J.6
-
31
-
-
0011627327
-
-
Gueguen, M., Petillon, F. Y., and Talarmin, J. Organometallics 1989, 8, 148-154
-
(1989)
Organometallics
, vol.8
, pp. 148-154
-
-
Gueguen, M.1
Petillon, F.Y.2
Talarmin, J.3
-
32
-
-
34447548905
-
-
Windhager, J., Rudolph, M., Bräutigam, S., Görls, H., and Weigand, W. Eur. J. Inorg. Chem. 2007, 2748-2760
-
(2007)
Eur. J. Inorg. Chem.
, pp. 2748-2760
-
-
Windhager, J.1
Rudolph, M.2
Bräutigam, S.3
Görls, H.4
Weigand, W.5
-
33
-
-
36448997749
-
-
Capon, J.-F., Ezzaher, S., Gloaguen, F., Petillon, F. Y., Schollhammer, P., Talarmin, J., Davin, T. J., McGrady, J. E., and Muir, K. W. New J. Chem. 2007, 31, 2052-2064
-
(2007)
New J. Chem.
, vol.31
, pp. 2052-2064
-
-
Capon, J.-F.1
Ezzaher, S.2
Gloaguen, F.3
Petillon, F.Y.4
Schollhammer, P.5
Talarmin, J.6
Davin, T.J.7
McGrady, J.E.8
Muir, K.W.9
-
34
-
-
0011837149
-
-
Teo, B. K., Hall, M. B., Fenske, R. F., and Dahl, L. F. J. Organomet. Chem. 1974, 70, 413-420
-
(1974)
J. Organomet. Chem.
, vol.70
, pp. 413-420
-
-
Teo, B.K.1
Hall, M.B.2
Fenske, R.F.3
Dahl, L.F.4
-
35
-
-
33847800977
-
-
Teo, B. K., Hall, M. B., Fenske, R. F., and Dahl, L. F. Inorg. Chem. 1975, 14, 3103-3117
-
(1975)
Inorg. Chem.
, vol.14
, pp. 3103-3117
-
-
Teo, B.K.1
Hall, M.B.2
Fenske, R.F.3
Dahl, L.F.4
-
38
-
-
0000744157
-
-
Shaik, S., Hoffmann, R., Fisel, C. R., and Summerville, R. H. J. Am. Chem. Soc. 1980, 102, 4555-4572
-
(1980)
J. Am. Chem. Soc.
, vol.102
, pp. 4555-4572
-
-
Shaik, S.1
Hoffmann, R.2
Fisel, C.R.3
Summerville, R.H.4
-
39
-
-
0011912485
-
-
Rizzi, G. A., Granozzi, G., Casarin, M., and Basato, M. Organometallics 1987, 6, 2536-2545
-
(1987)
Organometallics
, vol.6
, pp. 2536-2545
-
-
Rizzi, G.A.1
Granozzi, G.2
Casarin, M.3
Basato, M.4
-
40
-
-
0011914781
-
-
Reinhold, J., Muller, B., and Eichler, U. Organometallics 1997, 16, 1497-1500
-
(1997)
Organometallics
, vol.16
, pp. 1497-1500
-
-
Reinhold, J.1
Muller, B.2
Eichler, U.3
-
41
-
-
0034709826
-
-
Palacios, A. A., Aullon, G., Alemany, P., and Alvarez, S. Inorg. Chem. 2000, 39, 3166-3175
-
(2000)
Inorg. Chem.
, vol.39
, pp. 3166-3175
-
-
Palacios, A.A.1
Aullon, G.2
Alemany, P.3
Alvarez, S.4
-
42
-
-
0034721429
-
-
Baik, M.-H., Ziegler, T., and Schauer, C. K. J. Am. Chem. Soc. 2000, 122, 9143-9154
-
(2000)
J. Am. Chem. Soc.
, vol.122
, pp. 9143-9154
-
-
Baik, M.-H.1
Ziegler, T.2
Schauer, C.K.3
-
43
-
-
0037130677
-
-
Baik, M.-H., Schauer, C. K., and Ziegler, T. J. Am. Chem. Soc. 2002, 124, 11167-11181
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 11167-11181
-
-
Baik, M.-H.1
Schauer, C.K.2
Ziegler, T.3
-
44
-
-
0005479043
-
-
Gennett, T., Geiger, W. E., Willett, B., and Anson, F. C. J. Electroanal. Chem. 1987, 222, 151-160
-
(1987)
J. Electroanal. Chem.
, vol.222
, pp. 151-160
-
-
Gennett, T.1
Geiger, W.E.2
Willett, B.3
Anson, F.C.4
-
47
-
-
58949093182
-
-
Schrödinger, LLC: New York
-
Jaguar 7.0; Schrödinger, LLC: New York, 2007.
-
(2007)
Jaguar 7.0
-
-
-
48
-
-
0000216001
-
-
Vosko, S. H., Wilk, L., and Nusair, M. Can. J. Phys. 1980, 58, 1200-1211
-
(1980)
Can. J. Phys.
, vol.58
, pp. 1200-1211
-
-
Vosko, S.H.1
Wilk, L.2
Nusair, M.3
-
49
-
-
0345491105
-
-
Lee, C. T., Yang, W. T., and Parr, R. G. Phys. Rev. B 1988, 37, 785-789
-
(1988)
Phys. Rev. B
, vol.37
, pp. 785-789
-
-
Lee, C.T.1
Yang, W.T.2
Parr, R.G.3
-
52
-
-
33751157732
-
-
Stephens, P. J., Devlin, F. J., Chabalowski, C. F., and Frisch, M. J. J. Phys. Chem. 1994, 98, 11623-11627
-
(1994)
J. Phys. Chem.
, vol.98
, pp. 11623-11627
-
-
Stephens, P.J.1
Devlin, F.J.2
Chabalowski, C.F.3
Frisch, M.J.4
-
58
-
-
0030180875
-
-
Marten, B., Kim, K., Cortis, C., Friesner, R. A., Murphy, R. B., Ringnalda, M. N., Sitkoff, D., and Honig, B. J. Phys. Chem. 1996, 100, 11775-11788
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 11775-11788
-
-
Marten, B.1
Kim, K.2
Cortis, C.3
Friesner, R.A.4
Murphy, R.B.5
Ringnalda, M.N.6
Sitkoff, D.7
Honig, B.8
-
59
-
-
0031075977
-
-
Edinger, S. R., Cortis, C., Shenkin, P. S., and Friesner, R. A. J. Phys. Chem. B 1997, 101, 1190-1197
-
(1997)
J. Phys. Chem. B
, vol.101
, pp. 1190-1197
-
-
Edinger, S.R.1
Cortis, C.2
Shenkin, P.S.3
Friesner, R.A.4
-
65
-
-
70149091731
-
-
Lord, R. L., Schultz, F. A., and Baik, M.-H. J. Am. Chem. Soc. 2009, 131, 6189-6197
-
(2009)
J. Am. Chem. Soc.
, vol.131
, pp. 6189-6197
-
-
Lord, R.L.1
Schultz, F.A.2
Baik, M.-H.3
-
66
-
-
0000301294
-
-
Tissandier, M. D., Cowen, K. A., Feng, W. Y., Gundlach, E., Cohen, M. H., Earhart, A. D., Coe, J. V., and Tuttle, T. R. J. Phys. Chem. A 1998, 102, 7787-7794
-
(1998)
J. Phys. Chem. A
, vol.102
, pp. 7787-7794
-
-
Tissandier, M.D.1
Cowen, K.A.2
Feng, W.Y.3
Gundlach, E.4
Cohen, M.H.5
Earhart, A.D.6
Coe, J.V.7
Tuttle, T.R.8
-
67
-
-
0000301294
-
-
Tissandier, M. D., Cowen, K. A., Feng, W. Y., Gundlach, E., Cohen, M. H., Earhart, A. D., Tuttle, T. R., and Coe, J. V. J. Phys. Chem. A 1998, 102, 9308-9308
-
(1998)
J. Phys. Chem. A
, vol.102
, pp. 9308-9308
-
-
Tissandier, M.D.1
Cowen, K.A.2
Feng, W.Y.3
Gundlach, E.4
Cohen, M.H.5
Earhart, A.D.6
Tuttle, T.R.7
Coe, J.V.8
-
69
-
-
84961976132
-
-
Kelly, C. P., Cramer, C. J., and Truhlar, D. G. J. Phys. Chem. B 2006, 110, 16066-16081
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 16066-16081
-
-
Kelly, C.P.1
Cramer, C.J.2
Truhlar, D.G.3
-
70
-
-
51449118919
-
-
Fawcett, W. R. Langmuir 2008, 24, 9868-9875
-
(2008)
Langmuir
, vol.24
, pp. 9868-9875
-
-
Fawcett, W.R.1
-
71
-
-
0001041764
-
-
Shyu, S. G., Calligaris, M., Nardin, G., and Wojcicki, A. J. Am. Chem. Soc. 1987, 109, 3617-3625
-
(1987)
J. Am. Chem. Soc.
, vol.109
, pp. 3617-3625
-
-
Shyu, S.G.1
Calligaris, M.2
Nardin, G.3
Wojcicki, A.4
-
72
-
-
0000807347
-
-
Darensbourg, D. J., Sanchez, K. M., and Reibenspies, J. Inorg. Chem. 1988, 27, 3636-3643
-
(1988)
Inorg. Chem.
, vol.27
, pp. 3636-3643
-
-
Darensbourg, D.J.1
Sanchez, K.M.2
Reibenspies, J.3
-
73
-
-
0005107523
-
-
Zhuang, B., Huang, L., He, L., Yang, Y., and Lu, J. Inorg. Chim. Acta 1989, 157, 85-90
-
(1989)
Inorg. Chim. Acta
, vol.157
, pp. 85-90
-
-
Zhuang, B.1
Huang, L.2
He, L.3
Yang, Y.4
Lu, J.5
-
74
-
-
0011875823
-
-
Wong, W.-T. and Wong, W.-K. Acta Crystallogr., Sect. C 1994, 50, 1404-1406
-
(1994)
Acta Crystallogr., Sect. C
, vol.50
, pp. 1404-1406
-
-
Wong, W.-T.1
Wong, W.-K.2
-
75
-
-
0005211522
-
-
Zhuang, B., Huang, L., and He, L. Jiegou Huaxue (Chin. J. Struct. Chem.) 1995, 14, 359
-
(1995)
Jiegou Huaxue (Chin. J. Struct. Chem.)
, vol.14
, pp. 359
-
-
Zhuang, B.1
Huang, L.2
He, L.3
-
76
-
-
0031568519
-
-
Maitra, K., Catalano, V. J., and Nelson, J. H. J. Organomet. Chem. 1997, 529, 409-422
-
(1997)
J. Organomet. Chem.
, vol.529
, pp. 409-422
-
-
Maitra, K.1
Catalano, V.J.2
Nelson, J.H.3
-
77
-
-
0001595947
-
-
Zhuang, B., Sun, H., Pan, G., He, L., Wei, Q., Zhou, Z., Peng, S., and Wu, K. J. Organomet. Chem. 2001, 640, 127-139
-
(2001)
J. Organomet. Chem.
, vol.640
, pp. 127-139
-
-
Zhuang, B.1
Sun, H.2
Pan, G.3
He, L.4
Wei, Q.5
Zhou, Z.6
Peng, S.7
Wu, K.8
-
79
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77952139713
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note
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Starting with the oxidized species for a given square, it is natural to view reduction partitioned into vertical electron attachment (step a) followed by structural relaxation (step b), which takes place on the upper triangle of the square. The lower triangle involves a spontaneous structural deformation that is well-defined numerically but lacks physical motivation. Conversely, if we start with the reduced species (bottom right corner of i or ii), the lower triangle now becomes most meaningful by viewing oxidation as vertical ionization (step d) followed by structural relaxation (step c). All energy differences are referenced from left to right and from top to bottom.
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80
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77952185050
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note
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Computed with ΔG (sol)′: E ° = -1.501, -1.422, -0.724, and -0.732 V for 1 - 4, respectively.
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