Information card for entry 7712655

Structure parameters

• Formula: C8 H14 K6 N22 O15
• Calculated formula: C8 H14 K6 N22 O15
• Title of publication: Triazene Bridged Energetic Materials Based on Nitrotriazole: Synthesis, Characterization and Laser Ignited Combustion Performance
• Authors of publication: Jiang, Xiue; Yang, Yalin; Du, Huiying; Yang, Bo; Tang, Pengfei; Wu, Bo; Ma, Congming
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 12.0707 ± 0.0005 Å
• b: 7.3415 ± 0.0003 Å
• c: 18.2512 ± 0.0007 Å
• α: 90°
• β: 106.26 ± 0.002°
• γ: 90°
• Cell volume: 1552.67 ± 0.11 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0681
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1312
• Weighted residual factors for all reflections included in the refinement: 0.1401
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No