Information card for entry 4105662

Structure parameters

• Formula: C25.5 H23 Cl N2
• Calculated formula: C25.5 H23 Cl N2
• Title of publication: Redox-Neutral Indole Annulation Cascades
• Authors of publication: Michael C. Haibach; Indubhusan Deb; Chandra Kanta De; Daniel Seidel
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 2100 - 2103
• a: 7.9263 ± 0.0009 Å
• b: 9.9913 ± 0.0011 Å
• c: 13.9349 ± 0.0015 Å
• α: 100.827 ± 0.002°
• β: 99.715 ± 0.002°
• γ: 112.307 ± 0.002°
• Cell volume: 967.18 ± 0.19 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0594
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.1331
• Weighted residual factors for all reflections included in the refinement: 0.138
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No