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2-[(E)-(2-Morpholinoeth­yl)iminiometh­yl]-4-nitro-1-oxocyclo­hexa­dienide

The mol­ecule of the title compound, C(13)H(17)N(3)O(4), exists as a zwitterion, with the H atom of the phenol group being transferred to the imine N atom. The C=O, C(Ar)—C(Ar) and C—N bond lengths are in agreement with the oxocyclo­hexa­dienide–iminium zwitterionic form. A strong intra­molecular N(...

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Detalles Bibliográficos
Autores principales: Bingöl Alpaslan, Yelda, Tanak, Hasan, Ağar, Erbil, Erşahin, Ferda
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977119/
https://www.ncbi.nlm.nih.gov/pubmed/21583542
http://dx.doi.org/10.1107/S1600536809026191
Descripción
Sumario:The mol­ecule of the title compound, C(13)H(17)N(3)O(4), exists as a zwitterion, with the H atom of the phenol group being transferred to the imine N atom. The C=O, C(Ar)—C(Ar) and C—N bond lengths are in agreement with the oxocyclo­hexa­dienide–iminium zwitterionic form. A strong intra­molecular N(+)—H⋯O hydrogen bond generates an S(6) ring motif. The morpholine ring adopts a chair conformation. In the crystal, mol­ecules are linked into centrosymmetric dimers by inter­molecular N—H⋯O hydrogen bonds. In addition, C—H⋯O hydrogen bonds and very weak C—H⋯π inter­actions are observed.