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Computational predictions of stereochemistry in asymmetric thiazolium- and triazolium-catalyzed benzoin condensations

The catalytic asymmetric thiazolium- and triazolium-catalyzed benzoin condensations of aldehydes and ketones were studied with computational methods. Transition-state geometries were optimized by using Morokuma's IMOMO [integrated MO (molecular orbital) + MO method] variation of ONIOM (n-layere...

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Detalles Bibliográficos
Main Authors: Dudding, Travis, Houk, Kendall N.
Formato: Artigo
Idioma:Inglês
Publicado: National Academy of Sciences 2004
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Acceso en liña:https://ncbi.nlm.nih.gov/pmc/articles/PMC395983/
https://ncbi.nlm.nih.gov/pubmed/15079058
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1073/pnas.0307256101
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