Information card for entry 2210237

Structure parameters

• Chemical name: (E,E)-1,3-bis[9,10-dihydro-9-nitro-10-(trinitromethyl)-9-anthryl]propane
• Formula: C33 H24 N8 O16
• Calculated formula: C33 H24 N8 O16
• Title of publication: (<i>E</i>,<i>E</i>)-1,3-Bis[9,10-dihydro-9-nitro-10-(trinitromethyl)-9-anthryl]propane
• Authors of publication: Arslan, Mustafa; Asker, Erol; Masnovi, John; Baker, Ronald J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: o3650 - o3651
• a: 23.388 ± 0.003 Å
• b: 9.4054 ± 0.001 Å
• c: 16.3442 ± 0.0011 Å
• α: 90°
• β: 107.161 ± 0.007°
• γ: 90°
• Cell volume: 3435.2 ± 0.6 ų
• Cell temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1771
• Residual factor for significantly intense reflections: 0.0613
• Weighted residual factors for significantly intense reflections: 0.113
• Weighted residual factors for all reflections included in the refinement: 0.1404
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes