Information card for entry 2213080

Structure parameters

• Chemical name: 10-(4-Bromophenyl)-9-(4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7- tetrahydroacridine-1,8(2<i>H</i>,5<i>H</i>,9<i>H</i>,10<i>H</i>)-dione
• Formula: C30 H32 Br N O3
• Calculated formula: C30 H32 Br N O3
• SMILES: c1(ccc(cc1)Br)N1C2=C(C(=O)CC(C2)(C)C)C(c2ccc(cc2)OC)C2=C1CC(CC2=O)(C)C
• Title of publication: 10-(4-Bromophenyl)-9-(4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7-tetrahydroacridine-1,8(2<i>H</i>,5<i>H</i>,9<i>H</i>,10<i>H</i>)-dione
• Authors of publication: Odabaşoğlu, Mustafa; Kaya, Muharrem; Büyükgüngör, Orhan; Yıldırır, Yılmaz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 5
• Pages of publication: o2162 - o2164
• a: 12.2412 ± 0.0005 Å
• b: 10.9837 ± 0.0004 Å
• c: 20.1373 ± 0.0009 Å
• α: 90°
• β: 101.011 ± 0.004°
• γ: 90°
• Cell volume: 2657.69 ± 0.19 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.1114
• Weighted residual factors for all reflections included in the refinement: 0.121
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes