Information card for entry 1571294

Structure parameters

• Formula: C197 H228 Ag7 N4 O25 S16 Zr2
• Calculated formula: C197 H228 Ag7 N4 O25 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: 19.50529 ± 0.00011 Å
• b: 36.9188 ± 0.0002 Å
• c: 32.66914 ± 0.00016 Å
• α: 90°
• β: 98.6186 ± 0.0005°
• γ: 90°
• Cell volume: 23259.8 ± 0.2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• 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: 0.0845
• Residual factor for significantly intense reflections: 0.0672
• Weighted residual factors for significantly intense reflections: 0.1835
• Weighted residual factors for all reflections included in the refinement: 0.1947
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No