Information card for entry 1571293

Structure parameters

• Formula: C174 H184 Ag6 O22 S16 Zr2
• Calculated formula: C174 H184 Ag6 O22 S16 Zr2
• Title of publication: Ag¹⁺ incorporation <i>via</i> a Zr⁴⁺-anchored metalloligand: fine-tuning catalytic Ag sites in Zr/Ag bimetallic clusters for enhanced eCO₂RR-to-CO activity.
• Authors of publication: Li, Liang-Jun; Mu, Wen-Lei; Tian, Yi-Qi; Yu, Wei-Dong; Li, Lan-Yan; Yan, Jun; Liu, Chao
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 20
• Pages of publication: 7643 - 7650
• a: 21.2954 ± 0.0004 Å
• b: 42.655 ± 0.0009 Å
• c: 26.1848 ± 0.0005 Å
• α: 90°
• β: 109.152 ± 0.002°
• γ: 90°
• Cell volume: 22468.6 ± 0.8 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.1801
• Residual factor for significantly intense reflections: 0.1535
• Weighted residual factors for significantly intense reflections: 0.3093
• Weighted residual factors for all reflections included in the refinement: 0.3258
• Goodness-of-fit parameter for all reflections included in the refinement: 1.174
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No