Information card for entry 7237646

Structure parameters

• Formula: C H7 N9
• Calculated formula: C H7 N9
• Title of publication: A series of energetic cyclo-pentazolate salts: rapid synthesis, characterization, and promising performance
• Authors of publication: Xu, Yuangang; Tian, Lili; Li, Dongxue; Wang, Pengcheng; Lu, Ming
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 20
• Pages of publication: 12468
• a: 8.429 ± 0.005 Å
• b: 6.861 ± 0.005 Å
• c: 11.434 ± 0.008 Å
• α: 90°
• β: 98.964 ± 0.012°
• γ: 90°
• Cell volume: 653.2 ± 0.8 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 3
• 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: 0.1129
• Residual factor for significantly intense reflections: 0.0674
• Weighted residual factors for significantly intense reflections: 0.1831
• Weighted residual factors for all reflections included in the refinement: 0.2283
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No