Information card for entry 2222216

Structure parameters

• Chemical name: <i>N</i>'-(5-Bromo-2-methoxybenzylidene)-4-hydroxybenzohydrazide methanol solvate
• Formula: C16 H17 Br N2 O4
• Calculated formula: C16 H17 Br N2 O4
• SMILES: Brc1ccc(OC)c(c1)/C=N/NC(=O)c1ccc(O)cc1.OC
• Title of publication: <i>N</i>'-(5-Bromo-2-methoxybenzylidene)-4-hydroxybenzohydrazide methanol solvate
• Authors of publication: Lin, Xue-Song; Sang, Ya-Li
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 7
• Pages of publication: o1650
• a: 11.1886 ± 0.0007 Å
• b: 14.4464 ± 0.0009 Å
• c: 20.5927 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3328.5 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.0956
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.1557
• Weighted residual factors for all reflections included in the refinement: 0.1786
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes