Multiple catalysis in the CNDO/2 approximation. Formamidine catalysed 1,3-proton transfer in propene
Abstract
A CNDO/2 molecular orbital study of bifunctional and monofunctional formamidine catalysis of 1,3-proton transfers in propene shows that the energy barrier for bifunctional catalysis is much lower than that for monofunctional catalysis.
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