Crystal structure and DFT study of the zwitterionic form of 3-{(E)-1-[(4-ethoxyphenyl)iminiumyl]ethyl}-6-methyl-2-oxo-2H-pyran-4-olate

The title Schiff base compound, C(16)H(17)NO(4), crystallizes as a zwitterion, with the phenolic H atom having been transferred to the imino group. The resulting iminium and hy­droxy groups are linked by an intra­molecular N—H⋯O hydrogen bond, enclosing an S(6) ring motif. The conformation about the...

Descripción completa

Detalles Bibliográficos
Autores principales: Djedouani, Amel, Anak, Barkahem, Tabti, Salima, Cleymand, Franck, François, Michel, Fleutot, Solenne
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2018
Materias:
Research Communications
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5956330/
https://www.ncbi.nlm.nih.gov/pubmed/29850047
http://dx.doi.org/10.1107/S2056989018000919

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5956330/
https://www.ncbi.nlm.nih.gov/pubmed/29850047
http://dx.doi.org/10.1107/S2056989018000919

Ejemplares similares