Information card for entry 2235629

Structure parameters

• Chemical name: (<i>E</i>)-4-Amino-<i>N</i>'-(5-chloro-2-hydroxybenzylidene)benzohydrazide
• Formula: C14 H12 Cl N3 O2
• Calculated formula: C14 H12 Cl N3 O2
• SMILES: Clc1ccc(O)c(c1)/C=N/NC(=O)c1ccc(N)cc1
• Title of publication: (<i>E</i>)-4-Amino-<i>N</i>'-(5-chloro-2-hydroxybenzylidene)benzohydrazide
• Authors of publication: Kargar, Hadi; Kia, Reza; Tahir, Muhammad Nawaz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 7
• Pages of publication: o2118 - o2119
• a: 9.4243 ± 0.0008 Å
• b: 9.7975 ± 0.0009 Å
• c: 14.1924 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1310.45 ± 0.19 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0798
• Weighted residual factors for all reflections included in the refinement: 0.0841
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes