Information card for entry 7235793

Structure parameters

• Chemical name: HANTT
• Formula: C3 H5 N9 O3
• Calculated formula: C3 H5 N9 O3
• Title of publication: 3-Nitro-1-(2H-tetrazol-5-yl)-1H-1,2,4-triazol-5-amine (HANTT) and its energetic salts: highly thermally stable energetic materials with low sensitivity
• Authors of publication: Bian, Chengming; Zhang, Man; Li, Chuan; Zhou, Zhiming
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2015
• Journal volume: 3
• Journal issue: 1
• Pages of publication: 163
• a: 10.83 ± 0.004 Å
• b: 5.0641 ± 0.0018 Å
• c: 15.865 ± 0.006 Å
• α: 90°
• β: 106.122 ± 0.004°
• γ: 90°
• Cell volume: 835.9 ± 0.5 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0536
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.1034
• Weighted residual factors for all reflections included in the refinement: 0.1122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No