Title of article
Crystal structure and Hirshfeld surface analysis of (E)-N-(4-propyloxybenzylidene)benzo[d]thiazol-2-amine
Author/Authors
Sheakh Mohamad, Ropak A. Salahaddin University - College of Science - Department of Chemistry, Erbil, Iraq , Hamad, Wali M. Koya University - Faculty of Science and Health - Department of Chemistry, Koya, Iraq , Aziz, Hashim J. Salahaddin University - College of Education - Department of Chemistry, Erbil, Iraq , Dege, Necmi Ondokuz Mayıs University - Faculty of Arts and Sciences - Department of Physics, Turkey
Pages
9
From page
1
To page
9
Abstract
The title compound, C17H16N2OS, was synthesized by a condensation reaction between 2-amino benzothiazole and 4-N-propoxybenzaldehyde. The benzo[d]thiazole ring system is nearly planar (r.m.s. deviation 0.0088 Å) and makes a dihedral angle of 3.804 (12)° with the phenyl ring. The configuration about the C=N double bond is E. In the crystal structure, pairs of C—H⋯N hydrogen bonds and C—H⋯π interactions link the molecules into inversion dimers with an R22(16) ring motif. These dimers are additionally linked by weak π–π stacking interactions between the phenyl rings, leading to a layered arrangement parallel to (010). Hirshfeld surface analysis of the crystal structure indicates that the most important contributions for the packing arrangement are from H⋯H (47.9%) and C⋯H/H⋯C (25.6%) interactions.
Keywords
crystal structure , heterocyclic compound , Hirshfeld surface , Schiff base , 2-aminobenzothiazole
Journal title
Acta Crystallographica Section E: Crystallographic Communications
Serial Year
2020
Record number
2622776
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