Information card for entry 7710483

Structure parameters

• Formula: C2 H7 N7 O2
• Calculated formula: C2 H7 N7 O2
• SMILES: c1(C(=O)NN)n(nnn1)[O-].[NH4+]
• Title of publication: Nitrogen-rich ion salts of 1-hydroxytetrazole-5-hydrazide: a new series of high energy compounds that combine good stability and high energy performance
• Authors of publication: Yang, Feng; Qin, Yaqi; Wang, Pengcheng; Lin, Qiuhan; Xu, Yuangang; Lu, Ming
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 21.016 ± 0.004 Å
• b: 3.6758 ± 0.0007 Å
• c: 8.0868 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 624.7 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0586
• Residual factor for significantly intense reflections: 0.0542
• Weighted residual factors for significantly intense reflections: 0.1325
• Weighted residual factors for all reflections included in the refinement: 0.1353
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No