Information card for entry 1568778

Structure parameters

• Formula: C81 H189 Au13 Cl10 Ga5 P9
• Calculated formula: C81 H189 Au13 Cl10 Ga5 P9
• Title of publication: Synthesis and characterisation of four bimetallic gold–gallium clusters with Au–Ga rings as a new structural motif in gold cluster chemistry
• Authors of publication: Strienz, Markus; Fetzer, Florian; Schnepf, Andreas
• Journal of publication: Chemical Science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 17
• Pages of publication: 4571 - 4579
• a: 16.1624 ± 0.0005 Å
• b: 27.8938 ± 0.0008 Å
• c: 28.6686 ± 0.001 Å
• α: 90°
• β: 94.586 ± 0.001°
• γ: 90°
• Cell volume: 12883.3 ± 0.7 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 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: 0.0619
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0637
• Weighted residual factors for all reflections included in the refinement: 0.0771
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No