Information card for entry 2206864

Structure parameters

• Chemical name: 3,3-Bis(1H-indol-3-yl)indolin-2-one
• Formula: C24 H17 N3 O
• Calculated formula: C24 H17 N3 O
• SMILES: O=C1Nc2ccccc2C1(c1c2c([nH]c1)cccc2)c1c2c([nH]c1)cccc2
• Title of publication: 3,3-Bis(1<i>H</i>-indol-3-yl)indolin-2-one
• Authors of publication: S. Selvanayagam; Mahesh S. Chandak; D. Velmurugan; K. Ravikumar; R. Raghunathan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 10
• Pages of publication: o3122 - o3123
• a: 24.0578 ± 0.0012 Å
• b: 10.2342 ± 0.0005 Å
• c: 18.1597 ± 0.0009 Å
• α: 90°
• β: 125.861 ± 0.001°
• γ: 90°
• Cell volume: 3623.6 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0576
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1284
• Weighted residual factors for all reflections included in the refinement: 0.1344
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes