Crystal structure and Hirshfeld surface analysis of 3-benzyl-2-[bis(1H-pyrrol-2-yl)methyl]thiophene
| dc.contributor.author | Sadikhova, Nurlana D | |
| dc.contributor.author | Atioğlu, Zeliha | |
| dc.contributor.author | Guliyeva, Narmina A | |
| dc.contributor.author | Shelukho, Evgeniya R | |
| dc.contributor.author | Polyanskaya, Darya K | |
| dc.contributor.author | Khrustalev, Victor N | |
| dc.contributor.author | Akkurt, Mehmet | |
| dc.contributor.author | Bhattarai, Ajaya | |
| dc.date.accessioned | 2024-02-23T11:16:01Z | |
| dc.date.available | 2024-02-23T11:16:01Z | |
| dc.date.issued | 2023 | en_US |
| dc.department | Kapadokya Üniversitesi, Uygulamalı Bilimler Yüksekokulu, Havacılık Elektrik ve Elektroniği Bölümü | |
| dc.description.abstract | In the title compound, C20H18N2S, the asymmetric unit comprises two similar molecules (A and B). In molecule A, the central thiophene ring makes dihedral angles of 89.96?(12) and 57.39?(13)° with the 1H-pyrrole rings, which are bent at 83.22?(14)° relative to each other, and makes an angle of 85.98?(11)° with the phenyl ring. In molecule B, the corresponding dihedral angles are 89.49?(13), 54.64?(12)°, 83.62?(14)° and 85.67?(11)°, respectively. In the crystal, molecular pairs are bonded to each other by N—H?N interactions. N—H?? and C—H?? interactions further connect the molecules, forming a three-dimensional network. A Hirshfeld surface analysis indicates that H?H (57.1% for molecule A; 57.3% for molecule B), C?H/H?C (30.7% for molecules A and B) and S?H/H?S (6.2% for molecule A; 6.4% for molecule B) interactions are the most important contributors to the crystal packing. | |
| dc.identifier.endpage | 77 | en_US |
| dc.identifier.issue | 1 | en_US |
| dc.identifier.startpage | 72 | en_US |
| dc.identifier.uri | https://doi.org/10.1107/S2056989023010800 | |
| dc.identifier.uri | https://hdl.handle.net/20.500.12695/2676 | |
| dc.identifier.volume | 80 | en_US |
| dc.institutionauthor | Atioğlu, Zeliha | |
| dc.language.iso | en | |
| dc.relation.ispartof | Acta Cryst | |
| dc.relation.publicationcategory | Makale - Ulusal Hakemli Dergi - Kurum Öğretim Elemanı | |
| dc.rights | info:eu-repo/semantics/openAccess | en_US |
| dc.subject | [Keywords Not Available] | |
| dc.title | Crystal structure and Hirshfeld surface analysis of 3-benzyl-2-[bis(1H-pyrrol-2-yl)methyl]thiophene | |
| dc.type | Article |
