Information card for entry 2226693

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>'-(5-Bromo-2-hydroxybenzylidene)-2-methoxybenzohydrazide
• Formula: C15 H13 Br N2 O3
• Calculated formula: C15 H13 Br N2 O3
• SMILES: Brc1ccc(O)c(c1)/C=N/NC(=O)c1c(OC)cccc1
• Title of publication: (<i>E</i>)-<i>N</i>'-(5-Bromo-2-hydroxybenzylidene)-2-methoxybenzohydrazide
• Authors of publication: Liu, Shi-Yong; You, Zhonglu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1658
• a: 15.587 ± 0.003 Å
• b: 9.1281 ± 0.0019 Å
• c: 20.399 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2902.4 ± 1 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: 0.1197
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.0974
• Weighted residual factors for all reflections included in the refinement: 0.1268
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes