Information card for entry 2232850

Structure parameters

• Common name: 1-Methylhydrazinium picrate
• Chemical name: 1-Methylhydrazinium 2,4,6-trinitrophenolate
• Formula: C7 H9 N5 O7
• Calculated formula: C7 H9 N5 O7
• SMILES: N(=O)(=O)c1cc(N(=O)=O)cc(N(=O)=O)c1[O-].[NH2+](N)C
• Title of publication: 1-Methylhydrazinium picrate
• Authors of publication: Mu, Xiao-Gang; Wang, Xuan-Jun; Zhang, Youzhi; Gou, Xiaoli; Li, Xia
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: o3378
• a: 11.766 ± 0.003 Å
• b: 6.785 ± 0.002 Å
• c: 14.42 ± 0.004 Å
• α: 90°
• β: 110.526 ± 0.004°
• γ: 90°
• Cell volume: 1078.1 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• 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: 0.0456
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.097
• Weighted residual factors for all reflections included in the refinement: 0.1025
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes