Information card for entry 7246973

Structure parameters

• Formula: C228 H234 Ag10 Cu16 F24 O19 P4 S16
• Calculated formula: C216 H204 Ag10 Cu16 F24 O16 P4 S16
• Title of publication: Ag₁₀Cu₁₆ nanoclusters with triple-ligand protection: total structure and electronic structure analysis.
• Authors of publication: Sun, Xueli; Li, Simin; Tian, Guolong; Gao, Yanli; Wei, Jianyu; Shen, Hui
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 27
• Pages of publication: 17901 - 17906
• a: 18.3848 ± 0.0002 Å
• b: 34.2944 ± 0.0004 Å
• c: 18.6956 ± 0.0002 Å
• α: 90°
• β: 96.282 ± 0.001°
• γ: 90°
• Cell volume: 11716.7 ± 0.2 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 8
• 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: 0.0986
• Residual factor for significantly intense reflections: 0.0825
• Weighted residual factors for significantly intense reflections: 0.2456
• Weighted residual factors for all reflections included in the refinement: 0.2587
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No