Information card for entry 2311819

Structure parameters

• Chemical name: 1-Benzoyl-2-(4-hydroxybenzylidene)hydrazone methanol monosolvate
• Formula: C15 H16 N2 O3
• Calculated formula: C15 H16 N2 O3
• SMILES: O=C(N/N=C/c1ccc(O)cc1)c1ccccc1.OC
• Title of publication: Structural similarities among eight benzoylhydrazones.
• Authors of publication: Ton, Quoc Cuong; Bolte, Michael; Egert, Ernst
• Journal of publication: Acta crystallographica. Section C, Structural chemistry
• Year of publication: 2014
• Journal volume: 70
• Journal issue: Pt 9
• Pages of publication: 912 - 919
• a: 13.382 ± 0.001 Å
• b: 8.8183 ± 0.0008 Å
• c: 23.275 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2746.6 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0597
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.068
• Weighted residual factors for all reflections included in the refinement: 0.0731
• Goodness-of-fit parameter for all reflections included in the refinement: 0.803
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No