Information card for entry 1572829

Structure parameters

• Formula: C432 H192 Ag98 Cl4 F144
• Calculated formula: C432 H192 Ag98 Cl4 F144
• Title of publication: Substituent effect in determining the total structure of an all-alkynyl-protected Ag₉₈ nanocluster for methanol tolerant oxygen reduction reaction.
• Authors of publication: Cui, Xiaoqin; Zhang, Xuehuan; Li, Ting; Zhu, Sheng; Han, Gaoyi; Li, Huan
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 43
• Pages of publication: 18161 - 18169
• a: 32.4731 ± 0.0004 Å
• b: 32.4731 ± 0.0004 Å
• c: 96.4532 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 88083.5 ± 1.8 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.117
• Residual factor for significantly intense reflections: 0.0778
• Weighted residual factors for significantly intense reflections: 0.2263
• Weighted residual factors for all reflections included in the refinement: 0.2582
• Goodness-of-fit parameter for all reflections included in the refinement: 0.946
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No