Information card for entry 7053976

Structure parameters

• Common name: Hydrazinium_dinitromethanide
• Formula: C H6 N4 O4
• Calculated formula: C H6 N4 O4
• SMILES: N(=O)(=O)C=N([O-])=O.[NH3+]N
• Title of publication: Denitration of hydrazinium nitroformate to form hydrazinium dinitromethanide
• Authors of publication: Joo, Young-Hyuk; Min, Byoung Sun
• Journal of publication: New Journal of Chemistry
• Year of publication: 2014
• Journal volume: 38
• Journal issue: 1
• Pages of publication: 50
• a: 3.701 ± 0.003 Å
• b: 13.875 ± 0.011 Å
• c: 10.753 ± 0.009 Å
• α: 90°
• β: 98.833 ± 0.009°
• γ: 90°
• Cell volume: 545.6 ± 0.8 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: 0.1428
• Residual factor for significantly intense reflections: 0.0415
• Weighted residual factors for significantly intense reflections: 0.0843
• Weighted residual factors for all reflections included in the refinement: 0.1064
• Goodness-of-fit parameter for all reflections included in the refinement: 0.856
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No