Information card for entry 2209210

Structure parameters

• Chemical name: 10-Benzyl-7,8-dihydro-7,7-dimethyl-5-phenyl-5H-indeno[1,2-b]quinoline- 9,11(6H,10H)-dione
• Formula: C31 H27 N O2
• Calculated formula: C31 H27 N O2
• SMILES: O=C1C2=C(N(C3=C(C2Cc2ccccc2)C(=O)CC(C3)(C)C)c2ccccc2)c2c1cccc2
• Title of publication: 10-Benzyl-7,8-dihydro-7,7-dimethyl-5-phenyl-5<i>H</i>-indeno[1,2-<i>b</i>]quinoline-9,11(6<i>H</i>,10<i>H</i>)-dione
• Authors of publication: Shu-Jiang Tu; Bo Jiang; Cheng-Sheng Yao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 6
• Pages of publication: o2249 - o2251
• a: 14.783 ± 0.002 Å
• b: 9.4408 ± 0.0012 Å
• c: 16.345 ± 0.002 Å
• α: 90°
• β: 96.878 ± 0.003°
• γ: 90°
• Cell volume: 2264.7 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0678
• Residual factor for significantly intense reflections: 0.0562
• Weighted residual factors for significantly intense reflections: 0.1057
• Weighted residual factors for all reflections included in the refinement: 0.11
• Goodness-of-fit parameter for all reflections included in the refinement: 1.176
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes