Information card for entry 2222511

Structure parameters

• Chemical name: Ethyl 1-oxo-1,2,3,4-tetrahydro-9<i>H</i>-carbazole-3-carboxylate
• Formula: C15 H15 N O3
• Calculated formula: C15 H15 N O3
• SMILES: O=C1CC(Cc2c3ccccc3[nH]c12)C(=O)OCC
• Title of publication: Ethyl 1-oxo-1,2,3,4-tetrahydro-9<i>H</i>-carbazole-3-carboxylate
• Authors of publication: Hökelek, Tuncer; Dal, Hakan; Tercan, Barış; Göçmentürk, Mustafa; Ergün, Yavuz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 7
• Pages of publication: o1702 - o1703
• a: 5.6811 ± 0.0003 Å
• b: 8.7378 ± 0.0005 Å
• c: 24.831 ± 0.0014 Å
• α: 90°
• β: 93.208 ± 0.004°
• γ: 90°
• Cell volume: 1230.69 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1046
• Residual factor for significantly intense reflections: 0.0754
• Weighted residual factors for significantly intense reflections: 0.2023
• Weighted residual factors for all reflections included in the refinement: 0.2212
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes