Information card for entry 7236369

Structure parameters

• Common name: JZ 7-1
• Formula: C7 H8 N12 O8
• Calculated formula: C7 H8 N12 O8
• Title of publication: Bridged bisnitramide-substituted furazan-based energetic materials
• Authors of publication: Zhang, Jiaheng; Dharavath, Srinivas; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean'ne M.
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2016
• Journal volume: 4
• Journal issue: 43
• Pages of publication: 16961
• a: 14.3822 ± 0.0016 Å
• b: 9.5669 ± 0.0011 Å
• c: 11.2707 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1550.8 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.0229
• Residual factor for significantly intense reflections: 0.022
• Weighted residual factors for significantly intense reflections: 0.0566
• Weighted residual factors for all reflections included in the refinement: 0.0573
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No