Information card for entry 8104849

Structure parameters

• Formula: C15 H13 Br Cl2 N2 O3
• Calculated formula: C15 H13 Br Cl2 N2 O3
• Title of publication: Crystal structure of 4-bromo-N′-[3,5-dichloro-2-hydroxyphenyl)methylidene]benzohydrazide methanol solvate, C15H13BrCl2N2O3
• Authors of publication: Xu, Xindi; Huang, Meifen; Wang, Man; Li, Tianyu; Wu, Qiong
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2021
• Journal volume: 236
• Journal issue: 2
• Pages of publication: 421 - 423
• a: 7.4135 ± 0.0004 Å
• b: 13.3008 ± 0.0008 Å
• c: 16.9956 ± 0.0007 Å
• α: 90°
• β: 104.445 ± 0.002°
• γ: 90°
• Cell volume: 1622.88 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.06
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0909
• Weighted residual factors for all reflections included in the refinement: 0.1031
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No