Information card for entry 2202612

Structure parameters

• Chemical name: 3,3,6,6-tetramethyl-9-(3,4-methylenedioxylphenyl)- 1,2,3,4,5,6,7,8,9,10-decahydroacridines-1,8-dione
• Formula: C24 H27 N O4
• Calculated formula: C24 H27 N O4
• SMILES: O=C1CC(CC2=C1C(C1=C(N2)CC(CC1=O)(C)C)c1ccc2OCOc2c1)(C)C
• Title of publication: 3,3,6,6-Tetramethyl-9-(3,4-methylenedioxylphenyl)-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione
• Authors of publication: Yuling Li; Xiangshan Wang; Daqing Shi; Baixiang Du; Shujiang Tu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 10
• Pages of publication: o1446 - o1448
• a: 14.08 ± 0.002 Å
• b: 15.158 ± 0.003 Å
• c: 20.233 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4318.2 ± 1.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• 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: 0.1345
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.0739
• Weighted residual factors for all reflections included in the refinement: 0.0895
• Goodness-of-fit parameter for all reflections included in the refinement: 0.748
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes