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Tour, J.M.1
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For some syntheses of oligomers, see: (a) Tour, J. M. Chem. Rev. 1996, 96, 537. (b) Pearson, D. L.; Tour, J. M. J. Org. Chem. 1997, 62, 1376. (c) Nakanishi, H.; Sumi, N.; Aso, Y.; Otsubo, T. J. Org. Chem. 1998, 63, 8632.
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For some syntheses of oligomers, see: (a) Tour, J. M. Chem. Rev. 1996, 96, 537. (b) Pearson, D. L.; Tour, J. M. J. Org. Chem. 1997, 62, 1376. (c) Nakanishi, H.; Sumi, N.; Aso, Y.; Otsubo, T. J. Org. Chem. 1998, 63, 8632.
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(a) Kurotobi, K.; Takakura, K.; Murafuji, T.; Sugihara, Y. Synthesis 2001, 1346.
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(b) For our recent related work, see: Kurotobi, K.; Tabata, H.; Miyauchi, M.; Murafuji, T.; Sugihara, Y. Synthesis 2002, 1013.
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Shimoyama, H.1
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Ota, A.5
Fujimori, K.6
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10
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85087593936
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-
note
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8 at UHF/6-31G** level, based on the geometries optimized by semiempirical AM1 calculations.
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11
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0004133516
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Gaussian, Inc.: Pittsburgh PA
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Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A. Jr.; Stratmann, R. E.; Burant, 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.; Clifford, S.; Ochterski, J.; Petersson, G. A.; Ayala, P. Y.; Cui, 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 (Revision A.6); Gaussian, Inc.: Pittsburgh PA, 1998.
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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., Jr.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
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..
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12
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0346556839
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-
note
-
The total energy of anion A was found to lie by about 11 kcal/mol above that of biradical B.
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-
-
-
13
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11644312572
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For the MO calculations of such an electronic configuration, see: Hoffmann, R.; Zeiss, G. D.; Van Dine, G. W. J. Am. Chem. Soc. 1968, 90, 1485.
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Anderson, A. G. Jr.; Nelson, J. A.; Tazuma, J. J. J. Am. Chem. Soc. 1953, 75, 4980.
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0001070042
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For addition of lithium dicyclohexylamide to azulene, see; McDonald, R. N.; Petty, H. E.; Wolfe, N. L.; Paukstelis, J. V. J. Org. Chem. 1974, 39, 1877.
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Petty, H.E.2
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Paukstelis, J.V.4
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16
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0034701269
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For the generation of 5,6-azulyne from 5,6-dibromoazulene, see: Lu, Y.; Lemal, D. M.; Jasinski, J. P. J. Am. Chem. Soc. 2000, 122, 2440.
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Smith, P. A. S.; Rowe, C. D.; Bruner, L. B. J. Org. Chem. 1969, 34, 3430.
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0001688546
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Direct lithiation of 1,3-dichlorobenzene by butyllithium has been reported: Kress, T. H.; Leanna, M. R. Synthesis 1988, 803.
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Kress, T.H.1
Leanna, M.R.2
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0000636831
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For the bromination of 1,3-bisethoxycarbonyl-2-aminoazulene at the 6-position, see: Nozoe, T.; Seto, S.; Matsumura, S. Bull. Chem. Soc. Jpn. 1962, 35, 1990.
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