Information card for entry 1549724

Structure parameters

• Formula: C15 H9 F7.05
• Calculated formula: C15 H9 F7.0485
• Title of publication: <i>meta</i>-C-H arylation of fluoroarenes <i>via</i> traceless directing group relay strategy.
• Authors of publication: Font, Marc; Spencer, Andrew R. A.; Larrosa, Igor
• Journal of publication: Chemical science
• Year of publication: 2018
• Journal volume: 9
• Journal issue: 35
• Pages of publication: 7133 - 7137
• a: 12.069 ± 0.0005 Å
• b: 30.5791 ± 0.0011 Å
• c: 36.076 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13314.2 ± 1 ų
• Cell temperature: 150.02 ± 0.1 K
• Ambient diffraction temperature: 150.02 ± 0.1 K
• Number of distinct elements: 3
• Space group number: 57
• Hermann-Mauguin space group symbol: P b c m
• Hall space group symbol: -P 2c 2b
• Residual factor for all reflections: 0.2122
• Residual factor for significantly intense reflections: 0.1041
• Weighted residual factors for significantly intense reflections: 0.2713
• Weighted residual factors for all reflections included in the refinement: 0.3542
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No