Information card for entry 2233626

Structure parameters

• Chemical name: <i>N</i>'-(2-Chlorobenzylidene)-4-nitrobenzohydrazide
• Formula: C14 H10 Cl N3 O3
• Calculated formula: C14 H10 Cl N3 O3
• SMILES: Clc1c(cccc1)/C=N/NC(=O)c1ccc(N(=O)=O)cc1
• Title of publication: <i>N</i>'-(2-Chlorobenzylidene)-4-nitrobenzohydrazide
• Authors of publication: Tang, Chun-Bao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 2
• Pages of publication: o335
• a: 11.2332 ± 0.0018 Å
• b: 13.3778 ± 0.0018 Å
• c: 8.977 ± 0.0016 Å
• α: 90°
• β: 90.408 ± 0.002°
• γ: 90°
• Cell volume: 1349 ± 0.4 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: 0.087
• Residual factor for significantly intense reflections: 0.0509
• Weighted residual factors for significantly intense reflections: 0.1218
• Weighted residual factors for all reflections included in the refinement: 0.1458
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes