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Crystal structure and Hirshfeld surface analysis of (E)-1-[(4,7-dimethylquinolin-2-yl)methylidene]semicarbazide dihydrate
In the title compound, C(13)H(14)N(4)O·2H(2)O, the organic molecule is almost planar. In the crystal, the molecules are linked by O—H⋯O, N—H⋯O and O—H⋯N hydrogen bonds, forming a two-dimensional network parallel to (10[Image: see text]). Hirshfeld surface analysis and two-dimensional fingerprint p...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6218908/ https://www.ncbi.nlm.nih.gov/pubmed/30443404 http://dx.doi.org/10.1107/S2056989018014925 |
Sumario: | In the title compound, C(13)H(14)N(4)O·2H(2)O, the organic molecule is almost planar. In the crystal, the molecules are linked by O—H⋯O, N—H⋯O and O—H⋯N hydrogen bonds, forming a two-dimensional network parallel to (10[Image: see text]). Hirshfeld surface analysis and two-dimensional fingerprint plots indicate that the most important contributions to the crystal packing are from H⋯H (55.4%), H⋯O/O⋯H (14.8%), H⋯C/C⋯H (11.7%) and H⋯N/N⋯H (8.3%) interactions. |
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