Information card for entry 4022929

Structure parameters

• Formula: C32 H22 N2 O2
• Calculated formula: C32 H22 N2 O2
• SMILES: c12c3C(=O)c4c(c5ccccc5n4Cc4ccccc4)C(=O)c3n(c2cccc1)Cc1ccccc1
• Title of publication: SmI~2~-Promoted Radical Addition Reactions with N-(2-Indolylacyl)oxazolidinones: Synthesis of Bisindole Compounds
• Authors of publication: Karl B. Lindsay; Francesc Ferrando; Kasper L. Christensen; Jacob Overgaard; Tomàs Roca; M.-Lluïsa Bennasar; Troels Skrydstrup
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2007
• Journal volume: 72
• Pages of publication: 4181 - 4188
• a: 11.702 ± 0.004 Å
• b: 15.52 ± 0.005 Å
• c: 6.3747 ± 0.0018 Å
• α: 90°
• β: 102.619 ± 0.01°
• γ: 90°
• Cell volume: 1129.8 ± 0.6 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: 0.1225
• Residual factor for significantly intense reflections: 0.0635
• Weighted residual factors for significantly intense reflections: 0.1332
• Weighted residual factors for all reflections included in the refinement: 0.1528
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No