Information card for entry 8101174

Structure parameters

• Formula: C5 H8 N4 O3
• Calculated formula: C5 H8 N4 O3
• SMILES: [nH+]1c(cccc1N)N.N(=O)(=O)[O-]
• Title of publication: Crystal structure of 2,6-diaminopyridinium nitrate, C~5~H~8~N~3~NO~3~
• Authors of publication: Kristiansson, Olof
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2000
• Journal volume: 215
• Journal issue: 1
• Pages of publication: 138 - 138
• a: 3.7081 ± 0.0005 Å
• b: 9.9879 ± 0.0014 Å
• c: 10.4309 ± 0.0014 Å
• α: 90°
• β: 94.349 ± 0.002°
• γ: 90°
• Cell volume: 385.21 ± 0.09 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.0438
• Weighted residual factors for significantly intense reflections: 0.1032
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No