Information card for entry 2231246

Structure parameters

• Common name: 2,3-Diaminopyridine
• Chemical name: Pyridine-2,3-diamine
• Formula: C5 H7 N3
• Calculated formula: C5 H7 N3
• SMILES: n1c(N)c(N)ccc1
• Title of publication: Pyridine-2,3-diamine
• Authors of publication: Betz, Richard; Gerber, Thomas; Hosten, Eric; Schalekamp, Henk
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: o2154
• a: 16.467 ± 0.0003 Å
• b: 16.467 ± 0.0003 Å
• c: 3.9064 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1059.3 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 3
• Space group number: 106
• Hermann-Mauguin space group symbol: P 42 b c
• Hall space group symbol: P 4c -2ab
• Residual factor for all reflections: 0.0396
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0807
• Weighted residual factors for all reflections included in the refinement: 0.0847
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes