Information card for entry 8105160

Structure parameters

• Formula: C15 H13 Cl N2 O4
• Calculated formula: C15 H13 Cl N2 O4
• SMILES: Clc1ccc(O)c(C(=O)N/N=C/c2ccc(OC)cc2O)c1
• Title of publication: The crystal structure of (E)-5-chloro-2-hydroxy-N′-(2-hydroxy-4-methoxybenzylidene)benzohydrazide, C15H13ClN2O4
• Authors of publication: Xin, Wang; Shuli, Li; Liguo, Yang; Dayong, Tian; Yongsheng, Niu
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 3
• Pages of publication: 523 - 525
• a: 16.632 ± 0.002 Å
• b: 7.2033 ± 0.0009 Å
• c: 12.9261 ± 0.0017 Å
• α: 90°
• β: 112.87°
• γ: 90°
• Cell volume: 1426.9 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0533
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.1154
• Weighted residual factors for all reflections included in the refinement: 0.126
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No