Information card for entry 2220202

Structure parameters

• Chemical name: 4-Chloro-<i>N</i>-(2-pyridyl)aniline
• Formula: C11 H9 Cl N2
• Calculated formula: C11 H9 Cl N2
• SMILES: Clc1ccc(Nc2ncccc2)cc1
• Title of publication: 4-Chloro-<i>N</i>-(2-pyridyl)aniline
• Authors of publication: Wan Saffiee, Wan Ainna Mardhiah; Idris, Azila; Aiyub, Zaharah; Abdullah, Zanariah; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: o2437
• a: 15.5096 ± 0.0004 Å
• b: 7.5519 ± 0.0002 Å
• c: 17.6846 ± 0.0004 Å
• α: 90°
• β: 106.284 ± 0.002°
• γ: 90°
• Cell volume: 1988.25 ± 0.09 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.1034
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.1039
• Weighted residual factors for all reflections included in the refinement: 0.1367
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes