Information card for entry 2005565

Structure parameters

• Chemical name: 9-(2-Nitrophenyl)-3,3',6,6'-tetramethylhexahydroacridin-1,8-dione
• Formula: C23 H26 N2 O4
• Calculated formula: C23 H26 N2 O4
• SMILES: O=C1CC(C)(C)CC2=C1C(C1=C(N2)CC(C)(C)CC1=O)c1c(N(=O)=O)cccc1
• Title of publication: 3,3,6,6-Tetramethyl-9-(2-nitrophenyl)-3,4,5,6,9,10-hexahydroacridine-1,8(2<i>H</i>,7<i>H</i>)-dione
• Authors of publication: Brito-Arias, M.; Ramirez, G.; Rivas, R. E.; Molins, E.; Maniukiewicz, W.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 11
• Pages of publication: 2811 - 2814
• a: 26.542 ± 0.004 Å
• b: 10.089 ± 0.001 Å
• c: 20.922 ± 0.003 Å
• α: 90°
• β: 133.07 ± 0.02°
• γ: 90°
• Cell volume: 4092.8 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1022
• Residual factor for significantly intense reflections: 0.0625
• Weighted residual factors for all reflections: 0.2188
• Weighted residual factors for significantly intense reflections: 0.1722
• Goodness-of-fit parameter for all reflections: 0.996
• Goodness-of-fit parameter for significantly intense reflections: 1.07
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No