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2-(2-Amino-4-nitro­phen­yl)-7-nitro-4H-3,1-benzoxazin-4-one

In the title compound, C(14)H(8)N(4)O(6), the benzoxazin-4-one fused-ring system (r.m.s. deviation = 0.018 Å) is coplanar with the attached benzene ring [dihedral angle = 0.81 (4)°], there being an intra­molecular N—H⋯N hydrogen bond between them. Each nitro group is twisted out of the plane of the...

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Detalles Bibliográficos
Autores principales: Tiekink, Edward R. T., Wardell, James L.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998318/
https://www.ncbi.nlm.nih.gov/pubmed/24764879
http://dx.doi.org/10.1107/S1600536814000609
Descripción
Sumario:In the title compound, C(14)H(8)N(4)O(6), the benzoxazin-4-one fused-ring system (r.m.s. deviation = 0.018 Å) is coplanar with the attached benzene ring [dihedral angle = 0.81 (4)°], there being an intra­molecular N—H⋯N hydrogen bond between them. Each nitro group is twisted out of the plane of the attached benzene ring [O—N—C—C torsion angles = 167.94 (11) and 170.38 (11)°]. In the crystal, amine–nitro N—H⋯O hydrogen bonds lead to centrosymmetric dimeric aggregates that are connected into a three-dimensional architecture by oxazin­yl–nitro C—H⋯O and π–π inter­actions [inter-centroid distance between the oxazinyl and terminal benzene rings = 3.5069 (7) Å].