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N,N-Diethylanilinium 2,4-dioxo-5-(2,4,6-trinitrophenyl)-1,2,3,4-tetrahydropyrimidin-6-olate
In the crystal structure of the title molecular salt, C(10)H(16)N(+)·C(10)H(4)N(5)O(9) (−), the components are linked through a N—H⋯O hydrogen bonds. R (2) (2)(8) ring motifs are formed between inversion-related barbiturate residues. Two intramoleculer N—H⋯O hydrogen bonds are observed in the anio...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3239082/ https://www.ncbi.nlm.nih.gov/pubmed/22199930 http://dx.doi.org/10.1107/S1600536811049506 |
Sumario: | In the crystal structure of the title molecular salt, C(10)H(16)N(+)·C(10)H(4)N(5)O(9) (−), the components are linked through a N—H⋯O hydrogen bonds. R (2) (2)(8) ring motifs are formed between inversion-related barbiturate residues. Two intramoleculer N—H⋯O hydrogen bonds are observed in the anion. The dihedral angle between 2,4,6-trinitrophenyl and barbiturate rings is 53.6 (2)°. The N,N-diethylamine substituent is disordered and was modeled as two geometrically equivalent conformers with occupancies of 0.737 (2) and 0.273 (2). |
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