Information card for entry 4131542

Structure parameters

• Formula: C24 H19 Au F P
• Calculated formula: C24 Au F P
• SMILES: [Au]([P](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccc(F)cc1
• Title of publication: Oxidative 1,2-Difunctionalization of Ethylene via Gold-Catalyzed Oxyarylation.
• Authors of publication: Harper, Matthew J.; Emmett, Edward J.; Bower, John F.; Russell, Christopher A.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• Journal volume: 139
• Journal issue: 36
• Pages of publication: 12386 - 12389
• a: 8.6 ± 0.0002 Å
• b: 14.9179 ± 0.0004 Å
• c: 15.1241 ± 0.0004 Å
• α: 88.579 ± 0.0014°
• β: 89.7538 ± 0.0015°
• γ: 86.1002 ± 0.0013°
• Cell volume: 1935.24 ± 0.09 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: 0.024
• Residual factor for significantly intense reflections: 0.0192
• Weighted residual factors for significantly intense reflections: 0.0384
• Weighted residual factors for all reflections included in the refinement: 0.0396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No