Information card for entry 2211614

Structure parameters

• Chemical name: 5-(2-Chlorophenyl)-7,7-dimethyl-10-(4-methylphenyl)-7,8-dihydro-5H- indeno[1,2-b]quinoline-9,11(6H,10H)-dione dimethylformamide solvate
• Formula: C34 H33 Cl N2 O3
• Calculated formula: C34 H33 Cl N2 O3
• SMILES: Clc1c(C2C3=C(N(C4=C2C(=O)c2ccccc42)c2ccc(cc2)C)CC(CC3=O)(C)C)cccc1.O=CN(C)C
• Title of publication: 5-(2-Chlorophenyl)-7,7-dimethyl-10-(4-methylphenyl)-7,8-dihydro-5<i>H</i>-indeno[1,2-<i>b</i>]quinoline-9,11(6<i>H</i>,10<i>H</i>)-dione dimethylformamide solvate
• Authors of publication: Hong Jiang; Xiang-Shan Wang; Mei-Mei Zhang; Chang-Sheng Yao; Shu-Jiang Tu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: o5587 - o5589
• a: 10.872 ± 0.002 Å
• b: 11.655 ± 0.002 Å
• c: 11.689 ± 0.002 Å
• α: 92.1 ± 0.004°
• β: 99.73 ± 0.004°
• γ: 106.147 ± 0.004°
• Cell volume: 1396.8 ± 0.4 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.077
• Residual factor for significantly intense reflections: 0.0618
• Weighted residual factors for significantly intense reflections: 0.1494
• Weighted residual factors for all reflections included in the refinement: 0.158
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes