Information card for entry 1569670

Structure parameters

• Formula: C120 H80 Ag11.27 Au4.73 Cl16 O2 P4 S8
• Calculated formula: C120 H80 Ag11.292 Au4.708 Cl16 O2 P4 S8
• Title of publication: Probing the surface-active sites of metal nanoclusters with atomic precision: a case study of Au₅Ag₁₁.
• Authors of publication: Cao, Yaoyao; Xu, Ying; Shen, Honglei; Pan, Peiyao; Zou, Xuejuan; Kang, Xi; Zhu, Manzhou
• Journal of publication: Nanoscale
• Year of publication: 2023
• Journal volume: 15
• Journal issue: 33
• Pages of publication: 13784 - 13789
• a: 23.4047 ± 0.0007 Å
• b: 56.3203 ± 0.0016 Å
• c: 46.1622 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 60849 ± 3 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 8
• Space group number: 68
• Hermann-Mauguin space group symbol: C c c a :2
• Hall space group symbol: -C 2a 2ac
• Residual factor for all reflections: 0.1605
• Residual factor for significantly intense reflections: 0.1193
• Weighted residual factors for significantly intense reflections: 0.3143
• Weighted residual factors for all reflections included in the refinement: 0.3458
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No