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How Alkali Cations Catalyze Aromatic Diels‐Alder Reactions

We have quantum chemically studied alkali cation‐catalyzed aromatic Diels‐Alder reactions between benzene and acetylene forming barrelene using relativistic, dispersion‐corrected density functional theory. The alkali cation‐catalyzed aromatic Diels‐Alder reactions are accelerated by up to 5 orders o...

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Detalles Bibliográficos
Autores principales: Vermeeren, Pascal, Brinkhuis, Francine, Hamlin, Trevor A., Bickelhaupt, F. Matthias
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7187256/
https://www.ncbi.nlm.nih.gov/pubmed/32012430
http://dx.doi.org/10.1002/asia.202000009