Information card for entry 7237156

Structure parameters

• Formula: C8 N14 O20
• Calculated formula: C8 N14 O20
• Title of publication: Bipyrazole bearing ten nitro groups ‒ a novel highly dense oxidizer for forward-looking rocket propulsions
• Authors of publication: Dalinger, Igor L.; Suponitsky, Kyrill Yu.; Shkineva, Tatyana K.; Lempert, David B.; Sheremetev, Aleksei B.
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2018
• Journal volume: 6
• Journal issue: 30
• Pages of publication: 14780
• a: 9.9011 ± 0.0013 Å
• b: 10.5386 ± 0.0013 Å
• c: 19.291 ± 0.002 Å
• α: 90°
• β: 91.071 ± 0.003°
• γ: 90°
• Cell volume: 2012.5 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0781
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.1105
• Weighted residual factors for all reflections included in the refinement: 0.1302
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No