Information card for entry 2221533

Structure parameters

• Chemical name: <i>N</i>'-(3-Bromo-5-chloro-2-hydroxybenzylidene)-3,4,5-trihydroxybenzohydrazide methanol solvate
• Formula: C15 H14 Br Cl N2 O6
• Calculated formula: C15 H14 Br Cl N2 O6
• SMILES: Brc1c(O)c(cc(Cl)c1)C=NNC(=O)c1cc(O)c(O)c(O)c1.OC
• Title of publication: <i>N</i>'-(3-Bromo-5-chloro-2-hydroxybenzylidene)-3,4,5-trihydroxybenzohydrazide methanol solvate
• Authors of publication: Abdul Alhadi, Abeer A.; Ali, Hapipah Mohd.; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 4
• Pages of publication: o909
• a: 21.6157 ± 0.0003 Å
• b: 12.7408 ± 0.0002 Å
• c: 17.0803 ± 0.0002 Å
• α: 90°
• β: 136.641 ± 0.001°
• γ: 90°
• Cell volume: 3229.57 ± 0.1 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.026
• Residual factor for significantly intense reflections: 0.023
• Weighted residual factors for significantly intense reflections: 0.066
• Weighted residual factors for all reflections included in the refinement: 0.068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes