Information card for entry 2223181

Structure parameters

• Chemical name: 3-(4-Chlorophenyl)-1-(4-nitrophenyl)benzo[<i>f</i>]quinoline
• Formula: C25 H15 Cl N2 O2
• Calculated formula: C25 H15 Cl N2 O2
• SMILES: Clc1ccc(c2nc3c(c(c2)c2ccc(N(=O)=O)cc2)c2c(cc3)cccc2)cc1
• Title of publication: 3-(4-Chlorophenyl)-1-(4-nitrophenyl)benzo[<i>f</i>]quinoline
• Authors of publication: Wang, Shu-Liang; Li, Qing; Wang, Xiang-Shan; Tu, Shu-Jiang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 9
• Pages of publication: o2137
• a: 9.139 ± 0.0012 Å
• b: 9.535 ± 0.0011 Å
• c: 11.9668 ± 0.0017 Å
• α: 108.182 ± 0.004°
• β: 105.366 ± 0.004°
• γ: 92.739 ± 0.003°
• Cell volume: 945.6 ± 0.2 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.0599
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.1209
• Weighted residual factors for all reflections included in the refinement: 0.1285
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes