Information card for entry 2219493

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>'-(3,5-Dibromo-2-hydroxybenzylidene)-4-hydroxybenzohydrazide monohydrate
• Formula: C14 H12 Br2 N2 O4
• Calculated formula: C14 H12 Br2 N2 O4
• SMILES: Brc1c(O)c(cc(Br)c1)/C=N/NC(=O)c1ccc(O)cc1.O
• Title of publication: (<i>E</i>)-<i>N</i>'-(3,5-Dibromo-2-hydroxybenzylidene)-4-hydroxybenzohydrazide monohydrate
• Authors of publication: Wang, Xiao-Ya; Cao, Guo-Biao; Yang, Tao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 10
• Pages of publication: o2022
• a: 6.984 ± 0.0016 Å
• b: 12.678 ± 0.003 Å
• c: 17.722 ± 0.004 Å
• α: 90°
• β: 96.999 ± 0.004°
• γ: 90°
• Cell volume: 1557.5 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.0934
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.0907
• Weighted residual factors for all reflections included in the refinement: 0.1064
• 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