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Ethane-1,2-diaminium bis(4-carboxy-2-propyl-1H-imidazole-5-carboxyate) monohydrate
In the title hydrated molecular salt, C(2)H(10)N(2) (2+)·2C(8)H(9)N(2)O(4) (−)·H(2)O, an intramolecular O—H⋯O hydrogen bond occurs in the anion, forming an S(7) ring. The –CO(2) and –CO(2)H groups make dihedral angles of 3.2 (2) and 2.0 (3)°, respectively, with the five-membered ring. In the crysta...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414266/ https://www.ncbi.nlm.nih.gov/pubmed/22904799 http://dx.doi.org/10.1107/S1600536812029406 |
Sumario: | In the title hydrated molecular salt, C(2)H(10)N(2) (2+)·2C(8)H(9)N(2)O(4) (−)·H(2)O, an intramolecular O—H⋯O hydrogen bond occurs in the anion, forming an S(7) ring. The –CO(2) and –CO(2)H groups make dihedral angles of 3.2 (2) and 2.0 (3)°, respectively, with the five-membered ring. In the crystal, N—H⋯O, N—H⋯N and O—H⋯O hydrogen bonds lead to the formation of a three-dimensional supramolecular architecture. The methyl group in the anion is disordered over two sets of sites in a 0.716 (9):0.284 (9) ratio. The ethylenediamine cation is generated by symmetry and the water molecule lies on a twofold axis. |
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