Information card for entry 2207832

Structure parameters

• Chemical name: 9-(4-Bromophenyl)-3,3,6,6-tetramethyl-3,4,5,6,9,10-hexahydroacridine- 1,8(2H,7H)-dione
• Formula: C23 H26 Br N O2
• Calculated formula: C23 H26 Br N O2
• SMILES: Brc1ccc(C2C3=C(NC4=C2C(=O)CC(C4)(C)C)CC(CC3=O)(C)C)cc1
• Title of publication: 9-(4-Bromophenyl)-3,3,6,6-tetramethyl-3,4,5,6,9,10-hexahydroacridine-1,8(2<i>H</i>,7<i>H</i>)-dione
• Authors of publication: Jia-Ning Xu; Jin-Peng Zhang; Qian Wang; Xiao-Tong Zhu; Shu-Jiang Tu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 1
• Pages of publication: o226 - o227
• a: 14.1598 ± 0.0016 Å
• b: 14.0629 ± 0.0016 Å
• c: 10.8624 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2163 ± 0.4 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• 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: 0.08
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.0749
• Weighted residual factors for all reflections included in the refinement: 0.0906
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes