The asymmetric units of the title compounds both contain one nonplanar mol-ecule. In 4-benzyl-6-phenyl-4,5-di-hydro-pyridazin-3(2H)-one, C(17)H(14)N(2)O, (I), the phenyl and pyridazine rings are twisted with respect to each other, making a dihedral angle of 46.69â (9)°; the phenyl ring of the benzyl group is nearly perpendicular to the plane of the pyridazine ring, the dihedral angle being 78.31â (10)°. In methyl 2-[5-(2,6-di-chloro-benz-yl)-6-oxo-3-phenyl-1,4,5,6-tetra-hydropyridazin-1-yl]acetate, C(20)H(16)Cl(2)N(2)O(3), (II), the phenyl and pyridazine rings are twisted with respect to each other, making a dihedral angle of 21.76â (18)°, whereas the phenyl ring of the di-chloro-benzyl group is inclined to the pyridazine ring by 79.61â (19)°. In the crystal structure of (I), pairs of N-Hâ¯O hydrogen bonds link the mol-ecules into inversion dimers with an R (2) (2)(8) ring motif. In the crystal structure of (II), C-Hâ¯O hydrogen bonds generate dimers with R (1) (2)(7), R (2) (2)(16) and R (2) (2)(18) ring motifs. The Hirshfeld surface analyses of compound (I) suggests that the most significant contributions to the crystal packing are by Hâ¯H (48.2%), Câ¯H/Hâ¯C (29.9%) and Oâ¯H/Hâ¯O (8.9%) contacts. For compound (II), Hâ¯H (34.4%), Câ¯H/Hâ¯C (21.3%) and Oâ¯H/Hâ¯O (16.5%) inter-actions are the most important contributions.
Crystal structures and Hirshfeld surface analyses of 4-benzyl-6-phenyl-4,5-di-hydro-pyridazin-3(2H)-one and methyl 2-[5-(2,6-di-chloro-benz-yl)-6-oxo-3-phenyl-1,4,5,6-tetra-hydropyridazin-1-yl]acetate.
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作者:Dadou Said, Kansiz Sevgi, Daoui Said, El Kalai Fouad, Baydere Cemile, Saddik Rafik, Karrouchi Khalid, Dege Necmi, Benchat Noureddine
| 期刊: | Acta Crystallographica Section E: Crystallographic Communications | 影响因子: | 0.500 |
| 时间: | 2019 | 起止号: | 2019 Oct 22; 75(Pt 11):1679-1684 |
| doi: | 10.1107/S2056989019013707 | ||
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