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Origin of π-Facial Stereoselectivity in Thiophene 1-Oxide Cycloadditions
We report a DFT computational study (M06–2X) of π-facial selectivity in the Diels—Alder reactions of thiophene 1-oxide. The preference for the syn cycloaddition arises because the ground state geometry of thiophene 1-oxide is predistorted into an envelope conformation that resembles the syn transiti...
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| Publicado no: | J Org Chem |
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| Main Authors: | , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2018
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6314815/ https://ncbi.nlm.nih.gov/pubmed/29360357 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.joc.7b03016 |
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