Information card for entry 2207883

Structure parameters

• Chemical name: 2,4-Dichlorobenzaldehyde picolinoylhydrazone
• Formula: C13 H9 Cl2 N3 O
• Calculated formula: C13 H9 Cl2 N3 O
• SMILES: Clc1c(ccc(Cl)c1)/C=N/NC(=O)c1ncccc1
• Title of publication: 2,4-Dichlorobenzaldehyde picolinoylhydrazone
• Authors of publication: Xie, Yue-Hua; Sheng, Liang-Quan; Zhu, Wei; Shao, Si-Chang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 1
• Pages of publication: o26 - o27
• a: 10.5 ± 0.011 Å
• b: 17.763 ± 0.018 Å
• c: 14.757 ± 0.015 Å
• α: 90°
• β: 103.794 ± 0.014°
• γ: 90°
• Cell volume: 2673 ± 5 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: 0.084
• Residual factor for significantly intense reflections: 0.0422
• Weighted residual factors for significantly intense reflections: 0.0878
• Weighted residual factors for all reflections included in the refinement: 0.098
• Goodness-of-fit parameter for all reflections included in the refinement: 0.856
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes