Crystal structure and Hirshfeld surface studies of 4-bromo-2-chlorophenyl (2E)-3-[4-(pentyloxy)phenyl]prop-2-enoate
| dc.contributor.author | Kumar, M Harish | |
| dc.contributor.author | Kumar, S Santhosh | |
| dc.contributor.author | Devarajegowda, H C | |
| dc.contributor.author | Srinivasa, H T | |
| dc.contributor.author | Palakshamurthy, B S | |
| dc.date.accessioned | 2026-03-25T06:10:41Z | |
| dc.date.available | 2026-03-25T06:10:41Z | |
| dc.date.issued | 2025-10 | |
| dc.description | Open Access. | en_US |
| dc.description.abstract | The asymmetric unit of the compound C20H20BrClO3 contains one independent molecule in which the aromatic rings are oriented at a dihedral angle of 83.30 (2)°. An intramolecular C—H⋯O contact generates a five-membered S(5) ring motif. In the crystal, C—H⋯O hydrogen bonds link the molecules through R12(6), R22(10), R22(14) hydrogen-bond motifs. The structure is consolidated by C—H⋯π interactions. A Hirshfeld surface analysis of the crystal structure indicates that the most important contributions for the crystal packing are from H⋯H (32.8%), C⋯H/H⋯C (28.1%), O⋯H/H⋯O (14.0%) Br⋯H/H⋯Br (12.5%) and Cl⋯H/H⋯Cl (10.6%) interactions. | en_US |
| dc.identifier.citation | Acta Crystallographica E: Crystallographic Communications, 2025, Vol. 81 (10), p912-915 | en_US |
| dc.identifier.issn | 2056-9890 | |
| dc.identifier.uri | http://hdl.handle.net/2289/8694 | |
| dc.language.iso | en | en_US |
| dc.publisher | Acta Crystallographica E: Crystallographic Communications | en_US |
| dc.relation.uri | https://doi.org/10.1107/S2056989025003317 | en_US |
| dc.rights | © The Authors 2025 | en_US |
| dc.subject | crystal structure | en_US |
| dc.subject | 4-bromo-2-chlorophenyl | en_US |
| dc.subject | Hirshfeld surface | en_US |
| dc.title | Crystal structure and Hirshfeld surface studies of 4-bromo-2-chlorophenyl (2E)-3-[4-(pentyloxy)phenyl]prop-2-enoate | en_US |
| dc.type | Article | en_US |