Crystal structure and Hirshfeld surface analysis of ( E )-1-[(4,7-di-methyl-quinolin-2-yl)methyl-idene]semicarbazide dihydrate

Crystal structure and Hirshfeld surface analysis of ( E )-1-[(4,7-di-methyl-quinolin-2-yl)methyl-idene]semicarbazide dihydrate

In the title compound, C H N O·2H O, the organic mol-ecule is almost planar. In the crystal, the mol-ecules are linked by O-H⋯O, N-H⋯O and O-H⋯N hydrogen bonds, forming a two-dimensional network parallel to (10). Hirshfeld surface analysis and two-dimensional fingerprint plots indicate that the most...

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Veröffentlicht in:Acta crystallographica. Section E, Crystallographic communications Crystallographic communications, 2018-11, Vol.74 (Pt 11), p.1674-1677
Hauptverfasser: Aydemir, Ercan, Kansiz, Sevgi, Dege, Necmi, Genc, Hasan, Gaidai, Snizhana V
Format: Artikel
Sprache:eng
Schlagworte:
crystal structure
Hirshfeld surface
Research Communications
semicarbazone
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Zusammenfassung:In the title compound, C H N O·2H O, the organic mol-ecule is almost planar. In the crystal, the mol-ecules are linked by O-H⋯O, N-H⋯O and O-H⋯N hydrogen bonds, forming a two-dimensional network parallel to (10). 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%) inter-actions.
ISSN:2056-9890
2056-9890
DOI:10.1107/S2056989018014925