Information card for entry 7718617

Structure parameters

• Formula: C133 H231 Au32 Cl2 O3 P S20
• Calculated formula: C133 H231 Au32 Cl2 O3 P S20
• Title of publication: Phosphine-induced conversion from Au₃₆ to Au₃₂ for constructing a high-performance CO₂RR catalyst.
• Authors of publication: Ye, Jiansheng; Dai, Yali; Liu, Wenjun; Xu, Jingrou; Li, Jialing; Chen, Meng; Yang, Sha; Li, Qinzhen; Du, Yuanxin; Chai, Jinsong; Zhu, Manzhou
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 23
• Pages of publication: 9160 - 9168
• a: 19.6005 ± 0.0006 Å
• b: 31.8711 ± 0.0007 Å
• c: 33.0905 ± 0.0011 Å
• α: 90°
• β: 106.011 ± 0.002°
• γ: 90°
• Cell volume: 19869.4 ± 1 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0958
• Residual factor for significantly intense reflections: 0.0616
• Weighted residual factors for significantly intense reflections: 0.1471
• Weighted residual factors for all reflections included in the refinement: 0.1558
• Goodness-of-fit parameter for all reflections included in the refinement: 0.873
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No