Information card for entry 2230786

Structure parameters

• Chemical name: 3-Chloro-<i>N</i>'-(2-chloro-5-nitrobenzylidene)benzohydrazide
• Formula: C14 H9 Cl2 N3 O3
• Calculated formula: C14 H9 Cl2 N3 O3
• SMILES: Clc1c(cc(N(=O)=O)cc1)/C=N/NC(=O)c1cc(Cl)ccc1
• Title of publication: 3-Chloro-<i>N</i>'-(2-chloro-5-nitrobenzylidene)benzohydrazide
• Authors of publication: Zhang, Zhen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 7
• Pages of publication: o1639
• a: 7.77 ± 0.002 Å
• b: 24.254 ± 0.006 Å
• c: 7.889 ± 0.002 Å
• α: 90°
• β: 95.383 ± 0.003°
• γ: 90°
• Cell volume: 1480.2 ± 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: 0.119
• Residual factor for significantly intense reflections: 0.0595
• Weighted residual factors for significantly intense reflections: 0.1236
• Weighted residual factors for all reflections included in the refinement: 0.1516
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes