Information card for entry 4517584

Structure parameters

• Formula: C62 H47 Au B F20 N
• Calculated formula: C62 H47 Au B F20 N
• Title of publication: Influence of Carbene and Phosphine Ligands on the Catalytic Activity of Gold Complexes in the Hydroamination and Hydrohydrazination of Alkynes
• Authors of publication: Yazdani, Sima; Junor, Glen P.; Peltier, Jesse L.; Gembicky, Milan; Jazzar, Rodolphe; Grotjahn, Douglas B.; Bertrand, Guy
• Journal of publication: ACS Catalysis
• Year of publication: 2020
• Pages of publication: 5190
• a: 15.2805 ± 0.0009 Å
• b: 18.4692 ± 0.0012 Å
• c: 20.3195 ± 0.0013 Å
• α: 78.445 ± 0.001°
• β: 80.937 ± 0.001°
• γ: 82.219 ± 0.001°
• Cell volume: 5516.1 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0412
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.0555
• Weighted residual factors for all reflections included in the refinement: 0.0615
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No