A Molecular Electron Density Theory Study of the [3+2] Cycloaddition Reaction of an Azomethine Ylide with an Electrophilic Ethylene Linked to Triazole and Ferrocene Units

The [3+2] cycloaddition (32CA) reaction of an azomethine ylide (AY) with an electrophilic ethylene linked to triazole and ferrocene units has been studied within the Molecular Electron Density Theory (MEDT) at the ωB97X-D/6-311G(d,p) level. The topology of the electron localization function (ELF) of...

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Detalles Bibliográficos
Autores principales: Domingo, Luis R., Ríos-Gutiérrez, Mar, Barakat, Assem
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9571756/
https://www.ncbi.nlm.nih.gov/pubmed/36235069
http://dx.doi.org/10.3390/molecules27196532

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9571756/
https://www.ncbi.nlm.nih.gov/pubmed/36235069
http://dx.doi.org/10.3390/molecules27196532

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