Information card for entry 8103084

Structure parameters

• Chemical name: 2-chloro-<i>N'</i>-(2-hydroxy-3,5-dichlorobenzylidene)benzohydrazide methanol solvate, C~14~H~9~Cl~3~N~2~O~2~.CH~3~OH
• Formula: C15 H13 Cl3 N2 O3
• Calculated formula: C15 H13 Cl3 N2 O3
• SMILES: Clc1c(O)c(cc(Cl)c1)/C=N/NC(=O)c1c(Cl)cccc1.OC
• Title of publication: Crystal structure of 2-chloro-N'-(2-hydroxy-3,5-dichlorobenzylidene)benzohydrazide — methanol (1:1), C14H9Cl3N2O2 · CH3OH
• Authors of publication: Yu-Mei Hao
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 1
• Pages of publication: 47
• a: 11.172 ± 0.003 Å
• b: 9.713 ± 0.003 Å
• c: 15.671 ± 0.004 Å
• α: 90°
• β: 96.516 ± 0.003°
• γ: 90°
• Cell volume: 1689.5 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.0605
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0824
• Weighted residual factors for all reflections included in the refinement: 0.1
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No