Information card for entry 2232883

Structure parameters

• Chemical name: 2-[2-(2-Carboxyphenyl)hydrazinylidene]-3-oxo-<i>N</i>-phenylbutyramide
• Formula: C17 H15 N3 O4
• Calculated formula: C17 H15 N3 O4
• SMILES: N(/N=C(C(=O)C)\C(=O)Nc1ccccc1)c1c(C(=O)O)cccc1
• Title of publication: 2-[2-(2-Carboxyphenyl)hydrazinylidene]-3-oxo-<i>N</i>-phenylbutyramide
• Authors of publication: Dong, Jinlong; Zhang, Gailing; Guo, Meiyu; Wu, Chuan; Ren, Jianguo
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: o3408
• a: 15.5731 ± 0.0016 Å
• b: 5.3292 ± 0.0005 Å
• c: 18.7731 ± 0.0019 Å
• α: 90°
• β: 99.246 ± 0.001°
• γ: 90°
• Cell volume: 1537.8 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1096
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.104
• Weighted residual factors for all reflections included in the refinement: 0.1371
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes