Information card for entry 4133442

Structure parameters

• Formula: C108 H90 Au25 S2.38 Se15.62
• Calculated formula: C108 H90 Au25 S2.38 Se15.62
• Title of publication: Regiochemistry of Thiolate for Selenolate Ligand Exchange on Gold Clusters.
• Authors of publication: Hosier, Christopher A.; Ackerson, Christopher J.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 1
• Pages of publication: 309 - 314
• a: 16.615 ± 0.003 Å
• b: 16.617 ± 0.003 Å
• c: 16.798 ± 0.003 Å
• α: 70.27 ± 0.03°
• β: 74.99 ± 0.03°
• γ: 62.56 ± 0.03°
• Cell volume: 3844.6 ± 1.7 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: 0.0682
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.1707
• Weighted residual factors for all reflections included in the refinement: 0.1732
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 1 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No