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[8a] S. Inagaki, H. Fujimoto, K. Fukui, J. Am. Chem. Soc. 1976, 98, 4693-4701.
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4544290939
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note
-
The LUMO coefficients of 1 indicate that the largest coefficient is located at the C3 position, favorably for the 1,4-addition reaction. If the 1,2-addition product is formed, the initial N-phenyl-substituted hemiaminal may lose water to give the stable Schiff base.
-
-
-
-
31
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4544272841
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note
-
The AMI-calculated FMO energy levels (eV) are as follows: 1, LUMO -1.88, HOMO -9.65; 6, LUMO -1.60, HOMO -8.42; 8, LUMO -1.11, HOMO -8.90.
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33
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0141971237
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Field, K.W.3
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34
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0000604488
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[12a] SIR92: A. Altomare, M. C. Burla, M. Camalli, M. Cascarano, C. Giacovazzo, A. Guagliardi, G. Polidori, J. Appl. Cryst. 1994, 27, 435.
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Polidori, G.7
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36
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0002649888
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The Kynoch Press, Birmingham, England, Table 2.2A
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Cromer, D.T.1
Waber, J.T.2
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