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Inducing high exo selectivity in Diels–Alder reaction by dimethylborane substituent: a DFT study

In this work, the role of Lewis acid–base (LAB) interaction on the stereoselectivity of the Diels–Alder (DA) reaction has been studied by DFT in gas and solution (dichloromethane) phases. The calculations were performed at the B3LYP/6-311G++ (d, p) level. Two different series of DA reactions were in...

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Detalles Bibliográficos
Autores principales: Taherinia, Davood, Fattahi, Alireza
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9789069/
https://www.ncbi.nlm.nih.gov/pubmed/36564456
http://dx.doi.org/10.1038/s41598-022-26685-y