Information card for entry 7150919

Structure parameters

• Formula: C41 H40 Cl2 N2 O
• Calculated formula: C41 H40 Cl2 N2 O
• SMILES: ClCCl.n1(c2ccccc2c2c(c(c(c(O)c12)c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C)c1c2ccccc2n(c1)C)C
• Title of publication: An efficient synthesis of indolo[3,2-a]carbazoles via the novel acid catalyzed reaction of indoles and diaryl-1,2-diones
• Authors of publication: Nair, Vijay; Nandialath, Vidya; Abhilash, Keecherikunnel G.; Suresh, Eringathodi
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2008
• Journal volume: 6
• Journal issue: 10
• Pages of publication: 1738 - 1742
• a: 8.2446 ± 0.001 Å
• b: 14.3609 ± 0.0017 Å
• c: 15.8071 ± 0.0019 Å
• α: 111.22 ± 0.002°
• β: 95.001 ± 0.002°
• γ: 105.513 ± 0.002°
• Cell volume: 1645.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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 all reflections: 0.1344
• Residual factor for significantly intense reflections: 0.1089
• Weighted residual factors for significantly intense reflections: 0.2814
• Weighted residual factors for all reflections included in the refinement: 0.2994
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No