Information card for entry 8106498

Structure parameters

• Formula: C14 H11 Cl2 N
• Calculated formula: C14 H11 Cl2 N
• Title of publication: Crystal structure of N-(3,4-dichlorobenzylidene)-4-methylaniline, C14H11Cl2N
• Authors of publication: Yuan, Hua; Chen, Chunni; Wang, Linyan
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 2
• Pages of publication: 249 - 250
• a: 6.1494 ± 0.0003 Å
• b: 14.4196 ± 0.0005 Å
• c: 14.2686 ± 0.0008 Å
• α: 90°
• β: 97.055 ± 0.005°
• γ: 90°
• Cell volume: 1255.64 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0443
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0848
• Weighted residual factors for all reflections included in the refinement: 0.0894
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No