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A Molecular Electron Density Theory Study of the Synthesis of Spirobipyrazolines through the Domino Reaction of Nitrilimines with Allenoates

The reaction of diphenyl nitrilimine (NI) with methyl 1-methyl-allenoate yielding a spirobipyrazoline has been studied within molecular electron density theory (MEDT) at the MPWB1K/6-311G(d) computational level in dichloromethane. This reaction is a domino process that comprises two consecutive 32CA...

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Detalles Bibliográficos
Autores principales:	Domingo, Luis R., Ghodsi, Fatemeh, Ríos-Gutiérrez, Mar
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2019
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6891705/ https://www.ncbi.nlm.nih.gov/pubmed/31744134 http://dx.doi.org/10.3390/molecules24224159

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