The asymmetric unit of the title compound, C(25)H(18)N(6)·H(2)O, comproses two mol-ecules (I and II), together with a water mol-ecule. The terminal phenyl groups attached to the methyl groups of the mol-ecules I and II do not overlap completely, but are approximately perpendicular. In the crystal, the mol-ecules are connected by N-Hâ¯N, C-Hâ¯N, O-Hâ¯N and N-Hâ¯O hydrogen bonds with each other directly and through water mol-ecules, forming layers parallel to the (001) plane. C-Hâ¯Ï inter-actions between these layers ensure the cohesion of the crystal structure. A Hirshfeld surface analysis indicates that Hâ¯H (39.1% for mol-ecule I; 40.0% for mol-ecule II), Câ¯H/Hâ¯C (26.6% for mol-ecule I and 25.8% for mol-ecule II) and Nâ¯H/Hâ¯N (24.3% for mol-ecules I and II) inter-actions are the most important contributors to the crystal packing.
Crystal structure and Hirshfeld surface analysis of 2,4-di-amino-6-[(1Z,3E)-1-cyano-2,4-di-phenyl-penta-1,3-dien-1-yl]pyridine-3,5-dicarbo-nitrile monohydrate.
阅读:14
作者:Mamedov İbrahim G, Khrustalev Victor N, Akkurt Mehmet, Kerimli Fuad Sh, Bhattarai Ajaya, Khalilov Ali N, Naghiyev Farid N
| 期刊: | Acta Crystallographica Section E: Crystallographic Communications | 影响因子: | 0.500 |
| 时间: | 2024 | 起止号: | 2024 Apr 18; 80(Pt 5):495-500 |
| doi: | 10.1107/S2056989024002962 | ||
特别声明
1、本页面内容包含部分的内容是基于公开信息的合理引用;引用内容仅为补充信息,不代表本站立场。
2、若认为本页面引用内容涉及侵权,请及时与本站联系,我们将第一时间处理。
3、其他媒体/个人如需使用本页面原创内容,需注明“来源:[生知库]”并获得授权;使用引用内容的,需自行联系原作者获得许可。
4、投稿及合作请联系:info@biocloudy.com。
