Information card for entry 4023781

Structure parameters

• Formula: C24.4 H18 Cl1.6 F8 Si2
• Calculated formula: C24.4 H18 Cl1.6 F8 Si2
• Title of publication: 9,10-Disubstituted Octafluoroanthracene Derivatives via Palladium-Catalyzed Cross-Coupling
• Authors of publication: John F. Tannaci; Masahiro Noji; Jennifer L. McBee; T. Don Tilley
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2008
• Journal volume: 73
• Pages of publication: 7895 - 7900
• a: 7.1 ± 0.003 Å
• b: 19.122 ± 0.008 Å
• c: 18.911 ± 0.008 Å
• α: 90°
• β: 98.757 ± 0.007°
• γ: 90°
• Cell volume: 2537.4 ± 1.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.2369
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for significantly intense reflections: 0.1043
• Weighted residual factors for all reflections included in the refinement: 0.1271
• Goodness-of-fit parameter for all reflections included in the refinement: 0.619
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No