Information card for entry 2311202

Structure parameters

• Chemical name: <i>N</i>'-Benzoyl-5-methyl-1,3-diphenyl-1<i>H</i>-pyrazole-4-carbohydrazide
• Formula: C24 H20 N4 O2
• Calculated formula: C24 H20 N4 O2
• SMILES: O=C(NNC(=O)c1ccccc1)c1c(nn(c1C)c1ccccc1)c1ccccc1
• Title of publication: N'-Benzoyl-5-methyl-1,3-diphenyl-1H-pyrazole-4-carbohydrazide.
• Authors of publication: Chandra, ?; Srikantamurthy, N.; Kumar, Shamantha; Doreswamy, B. H.; Umesha, K. B.; Mahendra, M.
• Journal of publication: Acta crystallographica. Section E, Structure reports online
• Year of publication: 2013
• Journal volume: 69
• Journal issue: Pt 12
• Pages of publication: o1769
• a: 22.399 ± 0.015 Å
• b: 11.18 ± 0.008 Å
• c: 8.19 ± 0.006 Å
• α: 90°
• β: 97.378 ± 0.012°
• γ: 90°
• Cell volume: 2034 ± 2 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.0946
• Weighted residual factors for all reflections included in the refinement: 0.1038
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No