Information card for entry 7205564

Structure parameters

• Formula: C2 H2 N4
• Calculated formula: C2 H2 N4
• Title of publication: A novel stable high-nitrogen energetic material: 4,4′-azobis(1,2,4-triazole)
• Authors of publication: Qi, Cai; Li, Sheng-Hua; Li, Yu-Chuan; Wang, Yuan; Chen, Xu-Kun; Pang, Si-Ping
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2011
• Journal volume: 21
• Journal issue: 9
• Pages of publication: 3221
• a: 5.0316 ± 0.001 Å
• b: 6.4982 ± 0.0013 Å
• c: 10.301 ± 0.002 Å
• α: 90°
• β: 91.56 ± 0.03°
• γ: 90°
• Cell volume: 336.68 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.06
• Residual factor for significantly intense reflections: 0.0513
• Weighted residual factors for significantly intense reflections: 0.1512
• Weighted residual factors for all reflections included in the refinement: 0.1572
• Goodness-of-fit parameter for all reflections included in the refinement: 1.14
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No