Information card for entry 2230214

Structure parameters

• Chemical name: 3-Chloropyridin-2-amine
• Formula: C5 H5 Cl N2
• Calculated formula: C5 H5 Cl N2
• SMILES: Clc1c(nccc1)N
• Title of publication: 3-Chloropyridin-2-amine
• Authors of publication: Hu, Zhi-Nan; Yang, Hui-Bin; Luo, Huan; Li, Bin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 5
• Pages of publication: o1138
• a: 11.149 ± 0.008 Å
• b: 5.453 ± 0.004 Å
• c: 9.844 ± 0.007 Å
• α: 90°
• β: 90.581 ± 0.012°
• γ: 90°
• Cell volume: 598.4 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0692
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.1604
• Weighted residual factors for all reflections included in the refinement: 0.1815
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes