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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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| Autors principals: | , |
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| Format: | Artigo |
| Idioma: | Inglês |
| Publicat: |
National Academy of Sciences
2004
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| Matèries: | |
| Accés en línia: | 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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