Information card for entry 2232437

Structure parameters

• Chemical name: <i>N</i>'-(5-Bromo-2-hydroxybenzylidene)-3-nitrobenzohydrazide methanol monosolvate
• Formula: C15 H14 Br N3 O5
• Calculated formula: C15 H14 Br N3 O5
• SMILES: Brc1ccc(O)c(c1)/C=N/NC(=O)c1cc(N(=O)=O)ccc1.OC
• Title of publication: <i>N</i>'-(5-Bromo-2-hydroxybenzylidene)-3-nitrobenzohydrazide methanol monosolvate
• Authors of publication: Tang, Chun-Bao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: o3002
• a: 6.701 ± 0.002 Å
• b: 9.492 ± 0.003 Å
• c: 13.011 ± 0.003 Å
• α: 105.866 ± 0.002°
• β: 92.535 ± 0.002°
• γ: 94.496 ± 0.002°
• Cell volume: 791.7 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2523
• Residual factor for significantly intense reflections: 0.0734
• Weighted residual factors for significantly intense reflections: 0.1626
• Weighted residual factors for all reflections included in the refinement: 0.2363
• Goodness-of-fit parameter for all reflections included in the refinement: 0.93
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes