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Prediction of Enantioselectivity in Rhodium Catalyzed Hydrogenations | Synapse

December 29, 2008

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Prediction of Enantioselectivity in Rhodium Catalyzed Hydrogenations

PDPatrick J. DonoghueUniversity of Notre Dame PHPaul HelquistUniversity of Notre Dame PNPer‐Ola NorrbyAstraZeneca (Australia)

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Resumen

Using the Q2MM method, new molecular mechanics parameters were developed to perform initial screening of a chiral library to focus the experimental screening for the rhodium catalyzed hydrogenation of enamides. Computational predictions agree very well with experimental data.

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Cite This Study

Donoghue et al. (Mon,) studied this question.

synapsesocial.com/papers/6a04520da1e0da39c47e7fa7 https://doi.org/https://doi.org/10.1021/ja806246h

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