Information card for entry 7237135

Structure parameters

• Formula: C6 N8 O6
• Calculated formula: C6 N8 O6
• Title of publication: Boosting energetic performance by trimerizing furoxan
• Authors of publication: He, Chunlin; Gao, Haixiang; Imler, Gregory H.; Parrish, Damon A.; Shreeve, Jean'ne M.
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2018
• Journal volume: 6
• Journal issue: 20
• Pages of publication: 9391
• a: 7.7033 ± 0.0006 Å
• b: 19.087 ± 0.0012 Å
• c: 13.1208 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1929.2 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.1619
• Residual factor for significantly intense reflections: 0.1092
• Weighted residual factors for significantly intense reflections: 0.256
• Weighted residual factors for all reflections included in the refinement: 0.3067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No