Information card for entry 7235795

Structure parameters

• Formula: C5.46 H9.92 N14 O2.5
• Calculated formula: C5.461 H9.8448 N14 O2.5002
• 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: 17.869 ± 0.006 Å
• b: 7.864 ± 0.002 Å
• c: 18.347 ± 0.006 Å
• α: 90°
• β: 104.227 ± 0.004°
• γ: 90°
• Cell volume: 2499.1 ± 1.3 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0608
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1274
• Weighted residual factors for all reflections included in the refinement: 0.1371
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No