Information card for entry 2211373

Structure parameters

• Chemical name: 5-Cyclopropyl-7,7-dimethyl-10-(4-nitrophenyl)-7,8-dihydro-5H- indeno[1,2-b]quinoline-9,11(6H,10H)-dione
• Formula: C27 H24 N2 O4
• Calculated formula: C27 H24 N2 O4
• SMILES: O=C1C2=C(N(C3=C(C2c2ccc(N(=O)=O)cc2)C(=O)c2ccccc32)C2CC2)CC(C1)(C)C
• Title of publication: 5-Cyclopropyl-7,7-dimethyl-10-(4-nitrophenyl)-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
• Authors of publication: Zi-Qiang Tang; Bo Jiang; Run-Hong Jia
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: o5582 - o5584
• a: 28.768 ± 0.005 Å
• b: 8.9966 ± 0.0012 Å
• c: 17.703 ± 0.003 Å
• α: 90°
• β: 108.727 ± 0.004°
• γ: 90°
• Cell volume: 4339.2 ± 1.2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.076
• Residual factor for significantly intense reflections: 0.062
• Weighted residual factors for significantly intense reflections: 0.118
• Weighted residual factors for all reflections included in the refinement: 0.124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.2
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes