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Quantum Chemical Study of the Cycloaddition Reaction of Tropone with 1,1-Diethoxyethene Catalyzed by B(C(6)F(5))(3) or BPh(3)

[Image: see text] Cycloaddition reaction of tropone with 1,1-diethoxyethene catalyzed by Lewis acid (LA), B(C(6)F(5))(3) or BPh(3), was examined by using ωB97X-D-level density functional theory (DFT) calculations. In the absence of LA, the reaction proceeds in a stepwise fashion to form two chemical...

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Detalles Bibliográficos
Autores principales: Sakata, Ken, Suzuki, Sarina, Sugimoto, Tsubasa, Yoshikawa, Takeshi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10448487/
https://www.ncbi.nlm.nih.gov/pubmed/37636958
http://dx.doi.org/10.1021/acsomega.3c03560