Quantum chemical study of the mechanism of the Claisen amino rearrangement |
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| Authors: | I. B. Abdrakhmanov N. G. Nigmatullin B. G. Zykov Z. N. Saraeva O. A. Ponomarev G. A. Tolstikov |
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| Affiliation: | (1) Institute of Chemistry and Division of Physics, Bashkir Scientific Center, Urals Branch, Academy of Sciences of the USSR, Ufa;(2) Bashkir Agricultural Institute, Ufa |
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| Abstract: | Using the LCAO MO method in the MNDO approximation, we have compared the concerted [3, 3]-sigmatropic and stepwise mechanisms for the acid-catalyzed Claisen amino rearrangement. The latter is preferred.Translated from Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, No. 3, pp. 634–639, March, 1991. |
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