Acta Crystallographica Section E (Jul 2012)

(4Z)-4-[(2E)-1-Hydroxy-3-(3-nitrophenyl)prop-2-en-1-ylidene]-3-methyl-1-(4-methylphenyl)-1H-pyrazol-5(4H)-one

  • Faryal Chaudhry,
  • M. Nawaz Tahir,
  • Misbahul Ain Khan,
  • Abdul Qayyum Ather,
  • Nadia Asif

DOI
https://doi.org/10.1107/S1600536812025238
Journal volume & issue
Vol. 68, no. 7
pp. o2044 – o2044

Abstract

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In the title compound, C20H17N3O4, the dihedral angles between the heterocyclic ring and the toluene and nitrobenzene rings are 4.21 (15) and 11.43 (14)°, respectively. The whole molecule is close to planar (r.m.s. deviation for the 27 non-H atoms = 0.171 Å). Two S(6) rings are formed due to intramolecular C—H...O and O—H...O hydrogen bonds. In the crystal, inversion dimers linked by pairs of C—H...O bonds generate R22(10) loops and further C—H...O bonds link the dimers along the b-axis direction. There exist π–π interactions between the heterocyclic rings at a centroid–centroid distance of 3.7126 (10) Å and between the centroids of the benzene rings at a distance of 3.8710 (16) Å.