Information card for entry 2220871

Structure parameters

• Chemical name: 9-Ethyl-3-(2-methylbenzoyl)-9<i>H</i>-carbazole
• Formula: C22 H19 N O
• Calculated formula: C22 H19 N O
• SMILES: O=C(c1cc2c3c(n(CC)c2cc1)cccc3)c1ccccc1C
• Title of publication: 9-Ethyl-3-(2-methylbenzoyl)-9<i>H</i>-carbazole
• Authors of publication: Hang, Ye-Chao; Chen, Min-Dong; Wang, Yong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: o279
• a: 11.676 ± 0.002 Å
• b: 10.569 ± 0.002 Å
• c: 13.756 ± 0.003 Å
• α: 90°
• β: 96.48 ± 0.03°
• γ: 90°
• Cell volume: 1686.7 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1047
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.1453
• Weighted residual factors for all reflections included in the refinement: 0.1734
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes