Information card for entry 8103226

Structure parameters

• Formula: C15 H12 Cl2 N2 O3
• Calculated formula: C15 H12 Cl2 N2 O3
• SMILES: Clc1c(O)c(/C=N/NC(=O)c2c(OC)cccc2)cc(Cl)c1
• Title of publication: Crystal structure of 2-methoxy-N'-(3,5-dichloro-2-hydroxybenzylidene)benzohydrazide, C15H12Cl2N2O3
• Authors of publication: Zhe Hong; Xiao-Xu Xu; Yan Yu; Peng Liang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 4
• Pages of publication: 599
• a: 10.8451 ± 0.0019 Å
• b: 12.773 ± 0.002 Å
• c: 10.8527 ± 0.0017 Å
• α: 90°
• β: 96.688 ± 0.002°
• γ: 90°
• Cell volume: 1493.1 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.0756
• Weighted residual factors for all reflections included in the refinement: 0.0814
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No