Information card for entry 2219441

Structure parameters

• Common name: Acetoguanamine <i>N</i>,<i>N</i>-dimethylformamide solvate
• Chemical name: 2,4-diamino-6-methyl-1,3,5-triazine <i>N</i>,<i>N</i>-dimethylformamide solvate
• Formula: C7 H14 N6 O
• Calculated formula: C7 H14 N6 O
• SMILES: n1c(nc(nc1C)N)N.O=CN(C)C
• Title of publication: Acetoguanamine <i>N</i>,<i>N</i>-dimethylformamide solvate
• Authors of publication: Portalone, Gustavo
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 9
• Pages of publication: o1685
• a: 25.548 ± 0.002 Å
• b: 23.0626 ± 0.0019 Å
• c: 7.2689 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4282.9 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.074
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.119
• Weighted residual factors for all reflections included in the refinement: 0.127
• Goodness-of-fit parameter for all reflections included in the refinement: 0.91
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes