Information card for entry 4122759

Structure parameters

• Formula: C21 H48 Au B10 Cl2 F6 N5 O4 P2 S2
• Calculated formula: C21 H48 Au B10 Cl2 F6 N5 O4 P2 S2
• Title of publication: Facile oxidative addition of aryl iodides to gold(i) by ligand design: bending turns on reactivity.
• Authors of publication: Joost, Maximilian; Zeineddine, Abdallah; Estévez, Laura; Mallet Ladeira, Sonia; Miqueu, Karinne; Amgoune, Abderrahmane; Bourissou, Didier
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 42
• Pages of publication: 14654 - 14657
• a: 16.8086 ± 0.0008 Å
• b: 13.3678 ± 0.0006 Å
• c: 19.1005 ± 0.0009 Å
• α: 90°
• β: 103.857 ± 0.002°
• γ: 90°
• Cell volume: 4166.9 ± 0.3 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 10
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0557
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0609
• Weighted residual factors for all reflections included in the refinement: 0.0674
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No