Information card for entry 2222147

Structure parameters

• Chemical name: 1-[9-Ethyl-6-(2-methylbenzoyl)-9<i>H</i>-carbazol-3-yl]ethanone
• Formula: C24 H21 N O2
• Calculated formula: C24 H21 N O2
• SMILES: n1(c2ccc(C(=O)c3c(C)cccc3)cc2c2c1ccc(c2)C(=O)C)CC
• Title of publication: 1-[9-Ethyl-6-(2-methylbenzoyl)-9<i>H</i>-carbazol-3-yl]ethanone
• Authors of publication: Hang, Ye-Chao; Ji, Jin-Xiu; Chen, Min-Dong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: o1198
• a: 13.066 ± 0.003 Å
• b: 13.416 ± 0.003 Å
• c: 21.987 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3854.2 ± 1.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1724
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for significantly intense reflections: 0.1392
• Weighted residual factors for all reflections included in the refinement: 0.1782
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes