Synthesis and structure of 4-[(2,3,4,5,6-pentafluorophenoxy)carbonyl]phenyl 4-(tetradecyloxy)benzoate
| dc.additional | CCDC reference: 2561963 Crystal structure: contains datablock I. DOI: https://doi.org/10.1107/S2056989026006213/hb8225sup1.cif Structure factors: contains datablock I. DOI: https://doi.org/10.1107/S2056989026006213/hb8225Isup2.hkl Supplementary packing figures. DOI: https://doi.org/10.1107/S2056989026006213/hb8225sup3.docx Supporting information file. DOI: https://doi.org/10.1107/S2056989026006213/hb8225Isup4.cml | en_US |
| dc.contributor.author | Ahmed, Khaleel | |
| dc.contributor.author | Devarajegowda, H C | |
| dc.contributor.author | Bommalingaiah, B | |
| dc.contributor.author | Venkatareddy, G N | |
| dc.contributor.author | Srinivasa, H T | |
| dc.contributor.author | Palakshamurthy, B S | |
| dc.date.accessioned | 2026-09-18T06:06:54Z | |
| dc.date.available | 2026-09-18T06:06:54Z | |
| dc.date.issued | 2026-06-23 | |
| dc.description | Open Access. | en_US |
| dc.description.abstract | In the title molecule, C34H37F5O5, the dihedral angles between the central carbonylphenyl and adjacent perfluorophenoxy and (tetradecyloxy)benzoate rings are 74.19 (2) and 67.86 (2)°, respectively and the tetradecyl chain adopts an extended conformation. In the crystal, the molecules are linked by C—H⋯O and C—H⋯F hydrogen bonds, forming C(7) and C(10) chains, respectively, both running infinitely along [010]. The Hirshfeld surface analysis reveals that the major contributions to the two dimensional fingerprint plots are from H⋯H (49.4%), F⋯H/H⋯F (16.7%) and O⋯H/H⋯O (9.0%) contacts. An intermolecular interaction energy calculation shows that dispersion energy contributes the most to the consolidation of the structure. | en_US |
| dc.identifier.citation | Acta Crystallographica, 2026, Vol. 82 (7), p858-861 | en_US |
| dc.identifier.issn | 2056-9890 | |
| dc.identifier.uri | http://hdl.handle.net/2289/8843 | |
| dc.language.iso | en | en_US |
| dc.publisher | International Union of Crystallography | en_US |
| dc.relation.uri | https://doi.org/10.1107/S2056989026006213 | en_US |
| dc.rights | © International Union of Crystallography | en_US |
| dc.subject | crystal structure | en_US |
| dc.subject | tetradecyloxy | en_US |
| dc.subject | pentafluorophenoxy | en_US |
| dc.subject | Hirshfeld surface | en_US |
| dc.subject | hydrogen bond | en_US |
| dc.title | Synthesis and structure of 4-[(2,3,4,5,6-pentafluorophenoxy)carbonyl]phenyl 4-(tetradecyloxy)benzoate | en_US |
| dc.type | Article | en_US |