Information card for entry 7225500

Structure parameters

• Formula: C3 H11 N11 O
• Calculated formula: C3 H11 N11 O
• SMILES: [O-]/N=N/c1nnn(C)n1.C(=[NH2+])(NN)NN
• Title of publication: Nitrogen-rich hypergolic ionic salts based on (2-methyltetrazol-5-yl)diazotates
• Authors of publication: chen, fuxue; Wang, Qi; Lu, Huijie; Pang, Fu-Qing; Huang, Jinglun; Nie, Fude
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 15.703 ± 0.005 Å
• b: 3.7767 ± 0.0011 Å
• c: 16.028 ± 0.005 Å
• α: 90°
• β: 100.331 ± 0.005°
• γ: 90°
• Cell volume: 935.1 ± 0.5 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 4
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0597
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.1033
• Weighted residual factors for all reflections included in the refinement: 0.1157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No