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http://hdl.handle.net/2289/8694| Title: | Crystal structure and Hirshfeld surface studies of 4-bromo-2-chlorophenyl (2E)-3-[4-(pentyloxy)phenyl]prop-2-enoate |
| Authors: | Kumar, M Harish Kumar, S Santhosh Devarajegowda, H C Srinivasac, H T Palakshamurthy, B S |
| Keywords: | crystal structure 4-bromo-2-chlorophenyl Hirshfeld surface |
| Issue Date: | Oct-2025 |
| Publisher: | Acta Crystallographica E: Crystallographic Communications |
| Citation: | Acta Crystallographica E: Crystallographic Communications, 2025, Vol. 81 (10), p912-915 |
| 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. |
| Description: | Open Access. |
| URI: | http://hdl.handle.net/2289/8694 |
| ISSN: | 2056-9890 |
| Alternative Location: | https://doi.org/10.1107/S2056989025003317 |
| Copyright: | © The Authors 2025 |
| Appears in Collections: | Research Papers (SCM) |
Files in This Item:
| File | Description | Size | Format | |
|---|---|---|---|---|
| 2025_Acta Crystallographica E_Vol 81 (10)_p912-915.pdf Restricted Access | Open Access | 7.51 MB | Adobe PDF | View/Open Request a copy |
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