Prediction of Soai Reaction Enantioselectivity Induced by Crystals of N-(2-Thienylcarbonyl)glycine

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Prediction of Soai Reaction Enantioselectivity Induced by Crystals of N-(2-Thienylcarbonyl)glycine

The enantioselectivity of the autocatalytic alkylation of 2-tert-butylpyrimidyl-5-carbaldehyde, initiated by chiral crystals of N-(2-thienylcarbonyl)glycine, is predicted computationally. The results are in accord with the correlation of the stereochemical outcome of the reaction and the absolute st...

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Bibliographic Details
Main Authors:	Carter, Damien, Rohl, Andrew, Shtukenberg, A., Bian, S., Hu, C., Baylon, L., Kahr, B., Mineki, H., Abe, K., Kawasaki, T., Soai, K.
Format:	Journal Article
Published:	American Chemical Society 2012
Online Access:	http://pubs.acs.org/doi/abs/10.1021/cg300207d http://hdl.handle.net/20.500.11937/9789

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