-
2
-
-
0002110351
-
-
(b) Lautens, M.; Klute, W.; Tam, W. Chem. Rev. 1996, 96, 49.
-
(1996)
Chem. Rev.
, vol.96
, pp. 49
-
-
Lautens, M.1
Klute, W.2
Tam, W.3
-
3
-
-
0033405982
-
-
(c) Takahaahi, T.; Kotora, M.; Hara, R.; Xi, Z. Bull. Chem. Soc. Jpn. 1999, 72, 2591.
-
(1999)
Bull. Chem. Soc. Jpn.
, vol.72
, pp. 2591
-
-
Takahaahi, T.1
Kotora, M.2
Hara, R.3
Xi, Z.4
-
7
-
-
0034249727
-
-
(g) Sato, F.; Urabe, S.; Okamoto, S. Chem. Rev. 2000, 100, 2835.
-
(2000)
Chem. Rev.
, vol.100
, pp. 2835
-
-
Sato, F.1
Urabe, S.2
Okamoto, S.3
-
9
-
-
0043286352
-
-
(a) Reppe, W.; Schlichtung, O.; Klager, K.; Toepal, T. Liebigs Ann. Chem. 1948, 560, 3.
-
(1948)
Liebigs Ann. Chem.
, vol.560
, pp. 3
-
-
Reppe, W.1
Schlichtung, O.2
Klager, K.3
Toepal, T.4
-
11
-
-
15844405617
-
-
(a) Takahashi, T.; Kara, R.; Nishihara, Y.; Kotora, M. J. Am. Chem. Soc. 1996, 118, 5154.
-
(1996)
J. Am. Chem. Soc.
, vol.118
, pp. 5154
-
-
Takahashi, T.1
Kara, R.2
Nishihara, Y.3
Kotora, M.4
-
12
-
-
17344373284
-
-
(b) Takahashi, T.; Xi, Z.; Yamazaki, A.; Liu, Y.; Nakajima, K.; Kotora, M. J. Am. Chem. Soc. 1998, 120, 1672.
-
(1998)
J. Am. Chem. Soc.
, vol.120
, pp. 1672
-
-
Takahashi, T.1
Xi, Z.2
Yamazaki, A.3
Liu, Y.4
Nakajima, K.5
Kotora, M.6
-
13
-
-
0001405332
-
-
(c) Takahashi, T.; Tsai, F.-Y.; Li, Y.; Nakajima, K.; Kotora, M. J. Am. Chem. Soc. 1999, 121, 11093.
-
(1999)
J. Am. Chem. Soc.
, vol.121
, pp. 11093
-
-
Takahashi, T.1
Tsai, F.-Y.2
Li, Y.3
Nakajima, K.4
Kotora, M.5
-
14
-
-
0034709381
-
-
(d) Takahashi, T.; Tsai, F.-Y.; Kotora, M. J. Am. Chem. Soc. 2000, 122, 4994.
-
(2000)
J. Am. Chem. Soc.
, vol.122
, pp. 4994
-
-
Takahashi, T.1
Tsai, F.-Y.2
Kotora, M.3
-
15
-
-
0034723006
-
-
(e) Takahashi, T.; Kitamura, M.; Shen, B.; Nakajima, K. J. Am. Chem. Soc. 2000, 122, 12876.
-
(2000)
J. Am. Chem. Soc.
, vol.122
, pp. 12876
-
-
Takahashi, T.1
Kitamura, M.2
Shen, B.3
Nakajima, K.4
-
16
-
-
0037160425
-
-
(f) Takahashi, T.; Ishikawa, M.; Huo, S. J. Am. Chem. Soc. 2002, 124, 388.
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 388
-
-
Takahashi, T.1
Ishikawa, M.2
Huo, S.3
-
17
-
-
0037196313
-
-
(g) Takahashi, T.; Li, Y.: Stepnicka, P.; Kitamura. M.; Liu, Y.; Nakajima, K.; Kotora, M. J. Am. Chem. Soc. 2002, 124, 576.
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 576
-
-
Takahashi, T.1
Li, Y.2
Stepnicka, P.3
Kitamura, M.4
Liu, Y.5
Nakajima, K.6
Kotora, M.7
-
18
-
-
0037042297
-
-
(h) Takahashi, T.; Tsai, F.-Y.; Li, Y.; Wang, H.; Kondo, Y.; Yamanaka, M.; Nakajima, K.; Kotora, M. J. Am. Chem. Soc. 2002, 124, 6059.
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 6059
-
-
Takahashi, T.1
Tsai, F.-Y.2
Li, Y.3
Wang, H.4
Kondo, Y.5
Yamanaka, M.6
Nakajima, K.7
Kotora, M.8
-
19
-
-
0042125423
-
-
Xi, Z.-F.; Sato, K.; Gao, Y.; Lu, J.-M,; Takahashi, T. J. Am. Chem. Soc. 2003, 125, 9668.
-
(2003)
J. Am. Chem. Soc.
, vol.125
, pp. 9668
-
-
Xi, Z.-F.1
Sato, K.2
Gao, Y.3
Lu, J.-M.4
Takahashi, T.5
-
20
-
-
3042701698
-
-
(j) Zhou, X.; Li, Z.; Wang, H.; Kitamura, M.; Kanno, K.-I.; Nakajima, K.; Takahashi, T. J. Org. Chem., 2004, 69, 4559.
-
(2004)
J. Org. Chem.
, vol.69
, pp. 4559
-
-
Zhou, X.1
Li, Z.2
Wang, H.3
Kitamura, M.4
Kanno, K.-I.5
Nakajima, K.6
Takahashi, T.7
-
21
-
-
0034802561
-
-
(a) Suzuki, D.; Urabe, H.; Sato, F. J. Am. Chem. Soc. 2001, 123, 7925.
-
(2001)
J. Am. Chem. Soc.
, vol.123
, pp. 7925
-
-
Suzuki, D.1
Urabe, H.2
Sato, F.3
-
22
-
-
0037051610
-
-
(b) Suzuki, D.; Tanaka, R.; Urabe, M.; Sato, F. J. Am. Chem. Soc. 2002, 124, 3518.
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 3518
-
-
Suzuki, D.1
Tanaka, R.2
Urabe, M.3
Sato, F.4
-
23
-
-
0037151678
-
-
(c) Tanaka, R.; Nakano, Y.; Suzuki, D.; Urabe, M.; Sato, F. J. Am. Chem. Soc. 2002, 124, 9682.
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 9682
-
-
Tanaka, R.1
Nakano, Y.2
Suzuki, D.3
Urabe, M.4
Sato, F.5
-
24
-
-
20644436570
-
-
(a) Negishi, E.-I.; Cederbaum, F. E.; Takahashi, T. Tetrahedron Lett. 1986, 27, 2829.
-
(1986)
Tetrahedron Lett.
, vol.27
, pp. 2829
-
-
Negishi, E.-I.1
Cederbaum, F.E.2
Takahashi, T.3
-
26
-
-
0001292210
-
-
(a) Takahashi, T.; Suzuki, N.; Hasegawa, M.; Nitto, Y.; Aoyagi, K.; Saburi, M. Chem. Lett. 1992, 331.
-
(1992)
Chem. Lett.
, pp. 331
-
-
Takahashi, T.1
Suzuki, N.2
Hasegawa, M.3
Nitto, Y.4
Aoyagi, K.5
Saburi, M.6
-
27
-
-
0001836931
-
-
(b) Takahashi, T.; Xi, Z.; Rousset, C. J.; Suzuki, N. Chem. Lett. 1993, 1001.
-
(1993)
Chem. Lett.
, pp. 1001
-
-
Takahashi, T.1
Xi, Z.2
Rousset, C.J.3
Suzuki, N.4
-
28
-
-
0000643934
-
-
(c) Suzuki, N.; Kondakov, D. Y.; Takahashi, T. J. Am. Chem. Soc. 1998, 115, 8485.
-
(1998)
J. Am. Chem. Soc.
, vol.115
, pp. 8485
-
-
Suzuki, N.1
Kondakov, D.Y.2
Takahashi, T.3
-
29
-
-
18444365105
-
-
(d) Takahashi, T.; Xi, C.; Kotora, M. J. Chem. Soc., Chem. Commun. 1997, 2069.
-
(1997)
J. Chem. Soc., Chem. Commun.
, pp. 2069
-
-
Takahashi, T.1
Xi, C.2
Kotora, M.3
-
30
-
-
18444384342
-
-
(e) Xi, Z.; Fischer, R.: Hara, R.; Sun, W.-H.; Obora, Y.; Suzuki, N.; Nakajima, K.; Takahashi, T. J. Am. Chem. Soc. 1997, 119, 12644.
-
(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 12644
-
-
Xi, Z.1
Fischer, R.2
Hara, R.3
Sun, W.-H.4
Obora, Y.5
Suzuki, N.6
Nakajima, K.7
Takahashi, T.8
-
32
-
-
0343027980
-
-
(g) Takahashi, T.; Sun, W.-H.; Liu, Y.; Nakajima, K.; Kotora, M. Organometallics 1998, 17, 3841.
-
(1998)
Organometallics
, vol.17
, pp. 3841
-
-
Takahashi, T.1
Sun, W.-H.2
Liu, Y.3
Nakajima, K.4
Kotora, M.5
-
33
-
-
0001230410
-
-
(h) Takahashi, T.; Xi, C.; Xi, Z.; Kageyama, M.; Fischer, R.; Nakajima, K.; Negishi, E.-I. J. Org. Chem. 1998, 63, 6802.
-
(1998)
J. Org. Chem.
, vol.63
, pp. 6802
-
-
Takahashi, T.1
Xi, C.2
Xi, Z.3
Kageyama, M.4
Fischer, R.5
Nakajima, K.6
Negishi, E.-I.7
-
34
-
-
0033540664
-
-
Takahashi, T.; Huo, S.; Hara, R.; Noguchi, Y.; Nakajima, K.; Sun, W.-I. J. Am. Chem. Soc. 1999, 121, 1094.
-
(1999)
J. Am. Chem. Soc.
, vol.121
, pp. 1094
-
-
Takahashi, T.1
Huo, S.2
Hara, R.3
Noguchi, Y.4
Nakajima, K.5
Sun, W.-I.6
-
35
-
-
0033550274
-
-
(j) Takahashi, T.; Shen, B.; Nakajima, K.; Xi, Z. J. Org. Chem. 1999, 64, 8706.
-
(1999)
J. Org. Chem.
, vol.64
, pp. 8706
-
-
Takahashi, T.1
Shen, B.2
Nakajima, K.3
Xi, Z.4
-
36
-
-
0034607298
-
-
(k) Takahashi, T.; Xi, C.; Ura, Y.; Nakajima, K. J. Am. Chem. Soc. 2000, 122, 3228.
-
(2000)
J. Am. Chem. Soc.
, vol.122
, pp. 3228
-
-
Takahashi, T.1
Xi, C.2
Ura, Y.3
Nakajima, K.4
-
37
-
-
0034693098
-
-
Liu, Y.; Xi, C.; Hara, R.; Nakajima, K.; Yamazaki, A.; Kotora, M.; Takahashi, T. J. Org. Chem. 2000, 65, 6951.
-
(2000)
J. Org. Chem.
, vol.65
, pp. 6951
-
-
Liu, Y.1
Xi, C.2
Hara, R.3
Nakajima, K.4
Yamazaki, A.5
Kotora, M.6
Takahashi, T.7
-
38
-
-
0001135898
-
-
Takahashi, T.; Sun, W.-H.; Duan, Z.; Shen, B. Org, Lett. 2000, 2, 1197.
-
(2000)
Org, Lett.
, vol.2
, pp. 1197
-
-
Takahashi, T.1
Sun, W.-H.2
Duan, Z.3
Shen, B.4
-
39
-
-
0035250198
-
-
(n) Takahashi, T.; Li, Y.; Tsai, F.-Y.; Nakajima, K. Organometallics 2001, 20, 595.
-
(2001)
Organometallics
, vol.20
, pp. 595
-
-
Takahashi, T.1
Li, Y.2
Tsai, F.-Y.3
Nakajima, K.4
-
40
-
-
0035904254
-
-
(o) Takahashi, T.; Tsai, F.-Y.; Li, Y.; Nakajima, K. Organometallies 2001, 20, 4122.
-
(2001)
Organometallies
, vol.20
, pp. 4122
-
-
Takahashi, T.1
Tsai, F.-Y.2
Li, Y.3
Nakajima, K.4
-
41
-
-
18444402604
-
-
(p) Kotora, M.; Matsumura, M.; Goo, G.; Takahashi, T. Org. Lett. 2001, 3467.
-
(2001)
Org. Lett.
, pp. 3467
-
-
Kotora, M.1
Matsumura, M.2
Goo, G.3
Takahashi, T.4
-
42
-
-
0037138686
-
-
(q) Takahashi, T.; Li. Y.; Ito, T.; Xu, F.; Nakajima, K.; Liu, Y. J. Am. Chem. Soc. 2002, 124, 1144.
-
(2002)
J. Am. Chem. Soc.
, vol.124
, pp. 1144
-
-
Takahashi, T.1
Li, Y.2
Ito, T.3
Xu, F.4
Nakajima, K.5
Liu, Y.6
-
43
-
-
0032542569
-
-
(a) Mao, S. S. H.; Liu, F.-Q.; Tilley, T. D. J. Am. Chem. Soc. 1998, 120, 1193.
-
(1998)
J. Am. Chem. Soc.
, vol.120
, pp. 1193
-
-
Mao, S.S.H.1
Liu, F.-Q.2
Tilley, T.D.3
-
44
-
-
0037016539
-
-
(b) Schafer, L. L.; Nitschke, J. R.; Mao, S. S. H.; Liu, F.-Q.; Harder, G.; Haufe, M.; Tilley, T. D. Chem. Eur. J. 2002, 8, 74.
-
(2002)
Chem. Eur. J.
, vol.8
, pp. 74
-
-
Schafer, L.L.1
Nitschke, J.R.2
Mao, S.S.H.3
Liu, F.-Q.4
Harder, G.5
Haufe, M.6
Tilley, T.D.7
-
46
-
-
0001594778
-
-
(d) Nitschke, J. R.; Tilley, T. D. Angew. Chem., Int. Ed. 2001, 40, 2142.
-
(2001)
Angew. Chem., Int. Ed.
, vol.40
, pp. 2142
-
-
Nitschke, J.R.1
Tilley, T.D.2
-
47
-
-
0034827122
-
-
(e)Schafer, L. L.; Nitschke, J. R.; Tilley, T. D. J. Am. Chem. Soc. 2001, 123, 2683.
-
(2001)
J. Am. Chem. Soc.
, vol.123
, pp. 2683
-
-
Schafer, L.L.1
Nitschke, J.R.2
Tilley, T.D.3
-
48
-
-
0034715455
-
-
(f) Nitachke, J. R.; Zuercher, S.; Nitschke, J. R.; Tilley, T. D. J. Am. Chem. Soc. 2000, 122, 10345.
-
(2000)
J. Am. Chem. Soc.
, vol.122
, pp. 10345
-
-
Nitachke, J.R.1
Zuercher, S.2
Nitschke, J.R.3
Tilley, T.D.4
-
49
-
-
0000247506
-
-
(g) Liu, F.-Q.; Harder, G.: Tilley, T. D. J. Am. Chem. Soc. 1998, 120, 3271.
-
(1998)
J. Am. Chem. Soc.
, vol.120
, pp. 3271
-
-
Liu, F.-Q.1
Harder, G.2
Tilley, T.D.3
-
50
-
-
0034682917
-
-
(h) Suh, M. C.; Jiang, B.; Tilley, T. D. Angew. Chem., Int. Ed. 2000, 39, 2870.
-
(2000)
Angew. Chem., Int. Ed.
, vol.39
, pp. 2870
-
-
Suh, M.C.1
Jiang, B.2
Tilley, T.D.3
-
52
-
-
0034276363
-
-
(j) Lucht, B. L.; Buretea, M. A.; Tilley, T. D. Organometallics 2000, 19, 3469.
-
(2000)
Organometallics
, vol.19
, pp. 3469
-
-
Lucht, B.L.1
Buretea, M.A.2
Tilley, T.D.3
-
53
-
-
0032513710
-
-
(k) Lucht, B. L.; Mao, S. S. H.; Tilley, T. D. J. Am. Chem. Soc. 1998, 120, 4354.
-
(1998)
J. Am. Chem. Soc.
, vol.120
, pp. 4354
-
-
Lucht, B.L.1
Mao, S.S.H.2
Tilley, T.D.3
-
57
-
-
0000974285
-
-
(b) Fagan, P. J.; Nugent, W. A.; Calabresc, J. C. J. Am. Chem. Soc. 1994, 116, 1880.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 1880
-
-
Fagan, P.J.1
Nugent, W.A.2
Calabresc, J.C.3
-
58
-
-
0029903406
-
-
(a) Tamao, K.; Uchida, M.; Izumizawa, T.; Furukuwa, K.; Yamaguchi, S. J. Am. Chem. Soc. 1996, 118, 11974.
-
(1996)
J. Am. Chem. Soc.
, vol.118
, pp. 11974
-
-
Tamao, K.1
Uchida, M.2
Izumizawa, T.3
Furukuwa, K.4
Yamaguchi, S.5
-
59
-
-
0034845023
-
-
(b) Uchida, M.; Izumizawa, T.; Nakano, T.; Yamaguchi, S.; Tamao, K.; Furukawa, K. Chem. Mater. 2001, 13, 2680.
-
(2001)
Chem. Mater.
, vol.13
, pp. 2680
-
-
Uchida, M.1
Izumizawa, T.2
Nakano, T.3
Yamaguchi, S.4
Tamao, K.5
Furukawa, K.6
-
60
-
-
0035476608
-
-
Hay, C.; Hissler, M.; Fischmeistor, C.; Rault-Berthelet, J.; Toupet, L.; Nyulaszi, L.; Reau, R. Chem. Eur. J. 2001, 7, 4222.
-
(2001)
Chem. Eur. J.
, vol.7
, pp. 4222
-
-
Hay, C.1
Hissler, M.2
Fischmeistor, C.3
Rault-Berthelet, J.4
Toupet, L.5
Nyulaszi, L.6
Reau, R.7
-
61
-
-
37049108937
-
-
Boag, N. M.; Dias, G., H. M.; Green, M.; Spemcer, J. L.; Stone, F. G. A.; Vicente, J. J. Chem. Soc., Dulton Trans. 1981, 1981.
-
(1981)
J. Chem. Soc., Dulton Trans.
, pp. 1981
-
-
Boag, N.M.1
Dias, G.H.M.2
Green, M.3
Spemcer, J.L.4
Stone, F.G.A.5
Vicente, J.6
-
62
-
-
0001296230
-
-
(a) Tom Dieck, H.; Munz, C.; Muller, C. J. Organomet. Chem. 1990, 384, 243.
-
(1990)
J. Organomet. Chem.
, vol.384
, pp. 243
-
-
Tom Dieck, H.1
Munz, C.2
Muller, C.3
-
63
-
-
0001557551
-
-
(b) Tom Dieck, H.; Fendosak, G.; Munz, C. Polyhedron 1991, 10, 255.
-
(1991)
Polyhedron
, vol.10
, pp. 255
-
-
Tom Dieck, H.1
Fendosak, G.2
Munz, C.3
-
64
-
-
0037716504
-
-
Muller, C.; Lachicotte, R. J.; Jones, W. D. Organometallics 2002, 27, 1118.
-
(2002)
Organometallics
, vol.27
, pp. 1118
-
-
Muller, C.1
Lachicotte, R.J.2
Jones, W.D.3
-
65
-
-
0001584737
-
-
Wakatsuki, Y.; Nomura, O.; Kitaura, K.; Morokuma, K.; Yamazaki, H. J. Am. Chem. Soc. 1983, 105, 1907.
-
(1983)
J. Am. Chem. Soc.
, vol.105
, pp. 1907
-
-
Wakatsuki, Y.1
Nomura, O.2
Kitaura, K.3
Morokuma, K.4
Yamazaki, H.5
-
66
-
-
0033618072
-
-
Hardesty, J. H.; Koerner, J. B.; Albright, T. A.; Leo, G.-Y. J. Am. Chem. Soc. 1999, 121, 6055.
-
(1999)
J. Am. Chem. Soc.
, vol.121
, pp. 6055
-
-
Hardesty, J.H.1
Koerner, J.B.2
Albright, T.A.3
Leo, G.-Y.4
-
67
-
-
0141869037
-
-
Kirchner, K.; Calhorda, M. J.; Schmid, R.; Veiros, L. F. J. Am. Chem. Soc. 2003, 125, 11721.
-
(2003)
J. Am. Chem. Soc.
, vol.125
, pp. 11721
-
-
Kirchner, K.1
Calhorda, M.J.2
Schmid, R.3
Veiros, L.F.4
-
68
-
-
18444362261
-
-
(a) Sakaki, S.; Mine, K.; Taguchi, D.; Arai, T. Bull. Chem. Soc. Jpn. 1993, 66, 3299.
-
(1993)
Bull. Chem. Soc. Jpn.
, vol.66
, pp. 3299
-
-
Sakaki, S.1
Mine, K.2
Taguchi, D.3
Arai, T.4
-
69
-
-
0344565534
-
-
(b) Sakaki, S.; Mine, K.; Taguchi, D.; Arai, T. Bull. Chem. Soc. Jpn. 1695, 68, 1873.
-
(1695)
Bull. Chem. Soc. Jpn.
, vol.68
, pp. 1873
-
-
Sakaki, S.1
Mine, K.2
Taguchi, D.3
Arai, T.4
-
70
-
-
0037427254
-
-
Johnson, S. A.; Liu, F.-Q.; Suh, M. C.; Zurcher, S.; Haufe, M.; Mao, S. S. H.; Tilley, T. D. J. Am. Chem. Soc. 2003, 125, 4199.
-
(2003)
J. Am. Chem. Soc.
, vol.125
, pp. 4199
-
-
Johnson, S.A.1
Liu, F.-Q.2
Suh, M.C.3
Zurcher, S.4
Haufe, M.5
Mao, S.S.H.6
Tilley, T.D.7
-
72
-
-
18444384637
-
-
note
-
3) (see Table S1 in the Supporting Information).
-
-
-
-
73
-
-
18444379792
-
-
note
-
3) is considered a reasonable model.
-
-
-
-
74
-
-
34249935725
-
-
(c) Stekling, L.; Wilke, G. Angew. Chem., Int. Ed. Engl. 1988, 24, 496.
-
(1988)
Angew. Chem., Int. Ed. Engl.
, vol.24
, pp. 496
-
-
Stekling, L.1
Wilke, G.2
-
75
-
-
18444406403
-
-
note
-
2 as a substrate because our main purpose is to make clear comparisons in the reaction behavior and reactivity between early- and late-transition-metal complexes. It is likely that the bulky substituents increase the activation barrier of both early- and late-transition-metal-mediated coupling reactions.
-
-
-
-
78
-
-
0345491105
-
-
Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. B 1888, 37, 785.
-
(1888)
Phys. Rev. B
, vol.37
, pp. 785
-
-
Lee, C.1
Yang, W.2
Parr, R.G.3
-
81
-
-
43949164796
-
-
Höllwarth, A.; Böhme, M.; Dapprich, S.; Ehlers, A. W.; Gobbi, A.; Jonas, V.; Köhler, K. F.; Stegmann, R.; Veldkamp, A.; Freaking, G. Chem. Phys. Lett. 1993, 208, 237.
-
(1993)
Chem. Phys. Lett.
, vol.208
, pp. 237
-
-
Höllwarth, A.1
Böhme, M.2
Dapprich, S.3
Ehlers, A.W.4
Gobbi, A.5
Jonas, V.6
Köhler, K.F.7
Stegmann, R.8
Veldkamp, A.9
Freaking, G.10
-
82
-
-
36849115659
-
-
(a) Ditchfiled, R.; Hehre, W. J.; Pople, J. A. J. Chem. Phys. 1971, 54, 724.
-
(1971)
J. Chem. Phys.
, vol.54
, pp. 724
-
-
Ditchfiled, R.1
Hehre, W.J.2
Pople, J.A.3
-
85
-
-
43949164303
-
-
Ehlers, A. W.; Böhme, M.; Dapprich, S.; Gobbi, A.; Höllwarth, A.; Jonas, V.; Köhler, K. F.; Stegmann, R.; Veldkamp, A.; Frenking, G. Chem. Phys. Lett. 1983, 208, 111.
-
(1983)
Chem. Phys. Lett.
, vol.208
, pp. 111
-
-
Ehlers, A.W.1
Böhme, M.2
Dapprich, S.3
Gobbi, A.4
Höllwarth, A.5
Jonas, V.6
Köhler, K.F.7
Stegmann, R.8
Veldkamp, A.9
Frenking, G.10
-
86
-
-
26844534384
-
-
Krishnan, R.; Binkley, J. S.; Seeger, R.; Pople, J. A. J. Chem. Phys. 1980, 72, 650.
-
(1980)
J. Chem. Phys.
, vol.72
, pp. 650
-
-
Krishnan, R.1
Binkley, J.S.2
Seeger, R.3
Pople, J.A.4
-
90
-
-
0004133516
-
-
Gaussian Inc., Pittsburgh, PA
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A.; Stratmann, R. E.; Buront, J. C.; Dapprich, S.; Millam, J. M.; Daniels, A. D.; Kudin, K. N.; Strain, M. C.; Farkas, O.; Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B.; Pomelli, C.; Adamo, C.; Cliford, S.; Ochterski, J.; Petersson, G. A.; Ayala, P. Y.; Gui, Q.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Cioslowski, J.; Ortiz, J. V.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Gonzalez, C.; Challacombe, M.; Gill, P. M. W.; Johnson, B. G.; Chen, W.; Wong, M. W.; Andres, J. L.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian 98, Gaussian Inc., Pittsburgh, PA, 1998.
-
(1998)
Gaussian 98
-
-
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, J.A.8
Stratmann, R.E.9
Buront, 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
Cliford, S.24
Ochterski, J.25
Petersson, G.A.26
Ayala, P.Y.27
Gui, 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
Stefanov, B.B.36
Liu, G.37
Liashenko, A.38
Piskorz, P.39
Komaromi, I.40
Gomperts, R.41
Martin, R.L.42
Fox, D.J.43
Keith, T.44
Al-Laham, M.A.45
Peng, C.Y.46
Nanayakkara, A.47
Gonzalez, C.48
Challacombe, M.49
Gill, P.M.W.50
Johnson, B.G.51
Chen, W.52
Wong, M.W.53
Andres, J.L.54
Head-Gordon, M.55
Replogle, E.S.56
Pople, J.A.57
more..
-
91
-
-
0011530224
-
-
and references therein
-
Reed, A. E.; Curtis, L. A.; Weinhold, F. Chem. Rev. 1988, 88, 849 and references therein.
-
(1988)
Chem. Rev.
, vol.88
, pp. 849
-
-
Reed, A.E.1
Curtis, L.A.2
Weinhold, F.3
-
93
-
-
18444392839
-
-
note
-
2 becomes less stable in energy by 18.4 kcal/mol (DFT/BS-II calculation) relative to the precursor complex, when the C atom of the third acetylene approaches the Zr center at 2.5 A (see Figure S5 in the Supporting Information). The transition state could not be optimized at this moment, but it should be less stable than this geometry.
-
-
-
-
94
-
-
18444398167
-
-
note
-
2Zr, probably because the coupling product contains a very strained cyclobutene ring.
-
-
-
-
95
-
-
0001461406
-
-
(b) Warner, B. P.; Davis, W. M.; Buchwald, S. L. J. Am. Chem. Soc. 1994, 116, 5471.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 5471
-
-
Warner, B.P.1
Davis, W.M.2
Buchwald, S.L.3
-
96
-
-
18444387524
-
-
note
-
4-5.
-
-
-
-
97
-
-
84942791030
-
-
Wilkinson, G., Stone, F. G. A., Eds.; Pergamon: Oxford, U.K.
-
Hartley, F. R. In Comprehensive Organometallic Chemistry; Wilkinson, G., Stone, F. G. A., Eds.; Pergamon: Oxford, U.K., 1982; Vol. 6, p 471.
-
(1982)
Comprehensive Organometallic Chemistry
, vol.6
, pp. 471
-
-
Hartley, F.R.1
-
99
-
-
0042468352
-
-
(a) Sakaki, S.; Tsuru, N.; Ohkubo, K. J. Phys. Chem. 1980, 84, 3390.
-
(1980)
J. Phys. Chem.
, vol.84
, pp. 3390
-
-
Sakaki, S.1
Tsuru, N.2
Ohkubo, K.3
-
100
-
-
0000790605
-
-
(b) Kitaura, K.; Sakaki, S.; Morokuma, K. Inorg. Chem. 1981, 20, 2292.
-
(1981)
Inorg. Chem.
, vol.20
, pp. 2292
-
-
Kitaura, K.1
Sakaki, S.2
Morokuma, K.3
-
101
-
-
33847798583
-
-
Koroiya, S.; Albright, T. A.; Hoffmann, R.; Kochi, J. K. J. Am. Chem. Soc. 1976, 98, 7255.
-
(1976)
J. Am. Chem. Soc.
, vol.98
, pp. 7255
-
-
Koroiya, S.1
Albright, T.A.2
Hoffmann, R.3
Kochi, J.K.4
-
102
-
-
0000228530
-
-
Sakaki, S.; Kitaura, K.; Morokuma, K. Ohkubo, K. J. Am. Chem. Soc. 1983, 105, 2280.
-
(1983)
J. Am. Chem. Soc.
, vol.105
, pp. 2280
-
-
Sakaki, S.1
Kitaura, K.2
Morokuma, K.3
Ohkubo, K.4
-
103
-
-
18444395077
-
-
note
-
3 interacts with the π* orbital of acetylene in 9.
-
-
-
-
104
-
-
18444403863
-
-
note
-
This value of 0.3 means that the reaction proceeds by 30% from the transition state to the product.
-
-
-
-
105
-
-
18444366022
-
-
note
-
3)-mediated coupling reaction (see Figure 3). As a result, the energy change is not smoothly presented in Figure 4.
-
-
-
-
107
-
-
18444398479
-
-
note
-
3 takes the best position for the π-back-donation interaction with two acetylene molecules in 7 and 10.
-
-
-
-
108
-
-
18444417538
-
-
note
-
18,19
-
-
-
-
109
-
-
1642367216
-
-
Sakaki, S.; Takayama, T.; Suminioto, M.; Sugimoto, M. J. Am. Chem. Soc. 2004, 126, 3332.
-
(2004)
J. Am. Chem. Soc.
, vol.126
, pp. 3332
-
-
Sakaki, S.1
Takayama, T.2
Suminioto, M.3
Sugimoto, M.4
-
111
-
-
18444381289
-
-
note
-
2).
-
-
-
-
112
-
-
18444366888
-
-
note
-
The MeO ligand changes its orientation upon going from the reactant to the transition state and the product, as shown in Figure 1. It is likely that the MeO group easily rotates around the Zr-O bond.
-
-
-
|