Kansiz Sevgi, Macit Mustafa, Dege Necmi, Pavlenko Vadim A
Ondokuz Mayıs University, Faculty of Arts and Sciences, Department of Physics, 55139, Kurupelit, Samsun, Turkey.
Department of Chemistry, Faculty of Arts and Sciences, Ondokuz Mayıs, University, 55139, Samsun, Turkey.
Acta Crystallogr E Crystallogr Commun. 2018 Nov 30;74(Pt 12):1887-1890. doi: 10.1107/S2056989018016377. eCollection 2018 Dec 1.
The title Schiff base compound, CHClNO, shows mirror symmetry with all its non-H atoms, except the -butyl groups, located on the mirror plane. There is an intra-molecular O-H⋯N hydrogen bond present forming an (6) ring motif. In the crystal, the mol-ecules are connected by C-H⋯π inter-actions, generating a three-dimensional supra-molecular structure. Hirshfeld surface analysis and two dimensional fingerprint plots were used to analyse the inter-molecular inter-actions present in the crystal, indicating that the most important contributions for the crystal packing are from H⋯H (68.9%) and C⋯H/H⋯C (11.7%) inter-actions.
席夫碱化合物CHClNO的标题，除丁基外，其所有非氢原子都具有镜像对称性，且位于镜面上。存在分子内O-H⋯N氢键，形成(6)环 motif。在晶体中，分子通过C-H⋯π相互作用连接，形成三维超分子结构。使用 Hirshfeld 表面分析和二维指纹图谱来分析晶体中存在的分子间相互作用，表明晶体堆积的最重要贡献来自H⋯H（68.9%）和C⋯H/H⋯C（11.7%）相互作用。
