A Molecular Electron Density Theory Study of the Reactivity of Azomethine Imine in [3+2] Cycloaddition Reactions

The electronic structure and the participation of the simplest azomethine imine (AI) in [3+2] cycloaddition (32CA) reactions have been analysed within the Molecular Electron Density Theory (MEDT) using Density Functional Theory (DFT) calculations at the MPWB1K/6-311G(d) level. Topological analysis o...

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Detalles Bibliográficos
Autores principales: Domingo, Luis R., Ríos-Gutiérrez, Mar
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2017
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6154604/
https://www.ncbi.nlm.nih.gov/pubmed/28481228
http://dx.doi.org/10.3390/molecules22050750

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6154604/
https://www.ncbi.nlm.nih.gov/pubmed/28481228
http://dx.doi.org/10.3390/molecules22050750

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