Towards a rational design of enantioselective heterogeneous catalysts: Modeling of chiral organotin precursors

Abstract
In this work, the modeling of organotin compounds of general formula Men-Sn-R 3 null (Men = menthyl, R = alkyl or alkoxyalkyl) is carried out. These compounds can be employed as precursors for obtaining enantioselective heterogeneous catalysts, prepared by means of Surface Organometallic Chemistry on Metals techniques. Both Molecular Mechanics and Molecular Dynamics, as well as Density Functional Theory (DFT), were used to give an insight into...
Paper Details
Title
Towards a rational design of enantioselective heterogeneous catalysts: Modeling of chiral organotin precursors
Published Date
Aug 1, 2010
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