Part one
on this topic showed how a quantum mechanical model employing just one titanium centre was not successful in predicting the stereochemical outcome of the Sharpless asymmetric epoxidation. Here in part 2, I investigate whether a binuclear model might have more success. The new model is constructed using two units of Ti(OiPr)4, which are likely to assemble into a dimer such as that shown below (in this crystal structure, some of the iPr groups are perfluorinated).
Posts Tagged ‘This free energy difference’
Why the Sharpless epoxidation is enantioselective!
Monday, December 17th, 2012Tags: catalytic metal centre, Enantioselective, free energy difference, Sharpless epoxidation, t-butyl, This free energy difference
Posted in Interesting chemistry, Reaction Mechanism, Tutorial material | 2 Comments »
