Information card for entry 7236374

Structure parameters

• Formula: C5 H8 N12 O4
• Calculated formula: C5 H8 N12 O4
• Title of publication: 3,4-Dinitro-1-(1H-tetrazol-5-yl)-1H-pyrazol-5-amine (HANTP) and its salts: primary and secondary explosives
• Authors of publication: Fu, Wei; Zhao, Baojing; Zhang, Man; Li, Chuan; Gao, Huiqi; Zhang, Jun; Zhou, Zhiming
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2017
• Journal volume: 5
• Journal issue: 10
• Pages of publication: 5044
• a: 8.2623 ± 0.0007 Å
• b: 24.641 ± 0.002 Å
• c: 5.6882 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1158.07 ± 0.16 ų
• Cell temperature: 107.6 K
• Ambient diffraction temperature: 107.6 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0347
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.071
• Weighted residual factors for all reflections included in the refinement: 0.0735
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No