From Mechanistic Study to Chiral Catalyst Optimization: Theoretical Insight into Binaphthophosphepine-catalyzed Asymmetric Intramolecular [3 + 2] Cycloaddition

Density functional M11 was used to study the mechanism and enantioselectivity of a binaphthophosphepine-catalyzed intramolecular [3 + 2] cycloaddition reaction. The computational results revealed that this reaction proceeds through nucleophilic addition of the phosphine catalyst to the allene, which...

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Detalles Bibliográficos
Autores principales: Duan, Meng, Zhu, Lei, Qi, Xiaotian, Yu, Zhaoyuan, Li, Yingzi, Bai, Ruopeng, Lan, Yu
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2017
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5548760/
https://www.ncbi.nlm.nih.gov/pubmed/28790337
http://dx.doi.org/10.1038/s41598-017-07863-9

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5548760/
https://www.ncbi.nlm.nih.gov/pubmed/28790337
http://dx.doi.org/10.1038/s41598-017-07863-9

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