RESUMO
In the title compound, C6H4BrF3N4O2, the oxa-diazole ring is essentially planar with a maximum deviation of 0.003â (2)â Å. In the crystal, mol-ecular pairs are connected by N-Hâ¯N hydrogen bonds, forming dimers with an R 2 2(8) motif. The dimers are linked into layers parallel to the (10) plane by N-Hâ¯O hydrogen bonds. In addition, C-Oâ¯π and C-Brâ¯π inter-actions connect the mol-ecules, forming a three-dimensional network. The F atoms of the tri-fluoro-methyl group are disordered over two sites in a 0.515â (6): 0.485â (6) ratio. The inter-molecular inter-actions in the crystal structure were investigated and qu-anti-fied using Hirshfeld surface analysis.
RESUMO
In the title salt, C15H12FN2O+·Cl-·H2O, the imidazo[1,2-a]pyridin-1-ium ring system of the cation is almostly planar [maximum deviaition = -0.047â (2)â Å for the ring C atom with the attached arene ring] and forms a dihedral angle of 61.81â (6)° with the plane of the fluoro-phenyl ring. In the crystal, water mol-ecules form an R 2 4(8) motif parallel to the (100) plane by bonding with the chloride ions via O-Hâ¯Cl hydrogen bonds. The cations are connected along the b axis via N-Hâ¯O hydrogen bonds involving the O atoms of water mol-ecules, and C-Hâ¯O, C-Hâ¯Cl and π-π inter-actions [centroid-to-centroid distance = 3.6195â (8)â Å] form layers parallel to the (100) plane. Furthermore, these layers are connected via π-π inter-actions [centroid-to-centroid distance = 3.8051â (9)â Å] that further consolidate the crystal structure.