Information card for entry 2008825

Structure parameters

• Chemical name: [2-Amino-4,6-dimethyl-1,3,5-triazine]
• Formula: C5 H8 N4
• Calculated formula: C5 H8 N4
• SMILES: n1c(nc(nc1N)C)C
• Title of publication: 2-Amino-4,6-dimethyl-1,3,5-triazine
• Authors of publication: Becker, Michael; Jansen, Martin
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 8
• Pages of publication: IUC9900094
• a: 7.464 ± 0.0016 Å
• b: 7.85 ± 0.0019 Å
• c: 11.778 ± 0.004 Å
• α: 90 ± 0.02°
• β: 99.4 ± 0.02°
• γ: 90 ± 0.02°
• Cell volume: 680.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• 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: 0.074
• Residual factor for significantly intense reflections: 0.064
• Weighted residual factors for all reflections included in the refinement: 0.205
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71079 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No