3 research outputs found
1-(5-HydrÂoxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)ethanone: a new monoclinic polymorph
The title compound, C12H12N2O2, crystallized in the monolinic space group P21/n, with two independent molÂecules (A and B) in the asymmetric unit. This is in contrast to the first monoclinic polymorph reported [Cingolani et al. (2002 â–¶). Inorg. Chem.
41, 1151–116], which crystallized in the space group C2/c with one independent molÂecule per asymmetric unit. The dihedral angles between the two rings differ slightly; in molÂecule A it is 4.90 (11)° and in molÂecule B it is 16.05 (13)°. In both molÂecules, there is an intraÂmolecular O—H⋯O hydrogen bond involving the hydroxyl substituent and the carbonyl O atom of the adjacent acetyl group. In the crystal structure, molÂecules A and B are linked via a C—H⋯N interÂaction. There are also some weak C—H⋯π interÂactions involving the phenyl ring of molÂecule A and H atoms of the acetyl groups of both molÂecules