Information card for entry 2012491

Structure parameters

• Chemical name: 2-amino-5-thiolpyridine
• Formula: C5 H6 N2 S
• Calculated formula: C5 H5 N2 S
• SMILES: c1c(ccc(n1)N)[S]
• Title of publication: 6-Aminopyridine-3-thiol
• Authors of publication: Sabino, J. R.; da Silva, C. H. T. P.; Yonashiro, M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 2
• Pages of publication: o78 - o79
• a: 13.343 ± 0.0003 Å
• b: 5.756 ± 0.0003 Å
• c: 7.273 ± 0.0006 Å
• α: 90°
• β: 104.753 ± 0.003°
• γ: 90°
• Cell volume: 540.17 ± 0.05 ų
• Cell temperature: 100 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: 0.05
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.091
• Weighted residual factors for all reflections included in the refinement: 0.1
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No