Information card for entry 4066056

Structure parameters

• Formula: C22 H13 Au Cl F4 P
• Calculated formula: C22 H13 Au Cl F4 P
• SMILES: [Au](Cl)[P](c1cccc2c(F)c(F)c(F)c(F)c12)(c1ccccc1)c1ccccc1
• Title of publication: Remote C−F−Metal Interactions in Late-Transition-Metal Complexes
• Authors of publication: Stanek, Kyrill; Czarniecki, Barbara; Aardoom, Raphael; Rüegger, Heinz; Togni, Antonio
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 11
• Pages of publication: 2540
• a: 12.395 ± 0.0006 Å
• b: 9.059 ± 0.0005 Å
• c: 17.9686 ± 0.001 Å
• α: 90°
• β: 108.073 ± 0.002°
• γ: 90°
• Cell volume: 1918.08 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0374
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.0753
• Weighted residual factors for all reflections included in the refinement: 0.0781
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No