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Synthesis, crystal structure and Hirshfeld surface analysis of (4-methylphenyl)[1-(pentafluorophenyl)- 5-(trifluoromethyl)-1H-1,2,3-triazol-4-yl]methanone.
- Source :
-
Acta Crystallographica Section E: Crystallographic Communications . Nov2021, Vol. 77 Issue 11, p1067-1071. 5p. - Publication Year :
- 2021
-
Abstract
- The title compound, C17H7F8N3O, was obtained via the reaction of 1-azido-2,3,4,5,6-pentafluorobenzene with 4,4,4-trifluoro-1-(p-tolyl)butane-1,3-dione using triethylamine as a base catalyst and solvent. The dihedral angles between the pentafluorophenyl (A), triazole (B) and p-tolyl (C) rings are A/B = 62.3 (2), B/C = 43.9 (3) and A/C = 19.1 (3)·. In the crystal, the molecules are linked by C--H...F and C--H...O hydrogen bonds as well as by aromatic ... stacking interactions into a three-dimensional network. To further analyse the intermolecular interactions, a Hirshfeld surface analysis was performed. [ABSTRACT FROM AUTHOR]
Details
- Language :
- English
- ISSN :
- 20569890
- Volume :
- 77
- Issue :
- 11
- Database :
- Academic Search Index
- Journal :
- Acta Crystallographica Section E: Crystallographic Communications
- Publication Type :
- Academic Journal
- Accession number :
- 153773375
- Full Text :
- https://doi.org/10.1107/S2056989021010070