Crystal structure, DFT and Hirshfeld surface analysis of (E)-N'-[(1-chloro-3,4-di-hydro-naph-thal-en-2-yl)methyl-idene]benzohydrazide monohydrate.
Acta Crystallogr E Crystallogr Commun
; 76(Pt 2): 132-136, 2020 Feb 01.
Article
en En
| MEDLINE
| ID: mdl-32071734
ABSTRACT
In the title compound, C18H15ClN2O·H2O, a benzohydrazide derivative, the dihedral angle between the mean plane of the di-hydro-naphthalene ring system and the phenyl ring is 17.1â
(2)°. In the crystal, O-Hâ¯O, N-Hâ¯O and C-Hâ¯O hydrogen bonds link the benzohydrazide and water mol-ecules, forming a layer parallel to the bc plane. Hirshfeld surface analysis and two-dimensional fingerprint plots indicate that the most important contributions to the crystal packing are from Hâ¯H (45.7%) and Hâ¯C/Câ¯H (20.2%) contacts.
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