Information card for entry 2212935

Structure parameters

• Chemical name: Ethyl 2-(9-methylsulfonyl-1-oxo-2,3,4,9-tetrahydro-1H-carbazol-2-yl)acetate
• Formula: C17 H19 N O5 S
• Calculated formula: C17 H19 N O5 S
• SMILES: S(=O)(=O)(n1c2c(c3ccccc13)CCC(CC(=O)OCC)C2=O)C
• Title of publication: Ethyl 2-(9-methylsulfonyl-1-oxo-2,3,4,9-tetrahydro-1<i>H</i>-carbazol-2-yl)acetate
• Authors of publication: Özbey, Süheyla; Karayel, Arzu; Yılmaz, Ayhan; Uludağ, Nesi̇mi̇
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 4
• Pages of publication: o1623 - o1625
• a: 8.651 ± 0.001 Å
• b: 12.32 ± 0.001 Å
• c: 16.605 ± 0.002 Å
• α: 78.841 ± 0.007°
• β: 78.02 ± 0.01°
• γ: 81.33 ± 0.01°
• Cell volume: 1687.2 ± 0.3 ų
• Cell temperature: 295 ± 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 significantly intense reflections: 0.0704
• Weighted residual factors for all reflections included in the refinement: 0.2232
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes