Information card for entry 4133065

Structure parameters

• Formula: C150 H225 Ag4 Au19 S15
• Calculated formula: C150 H225 Ag4 Au19 S15
• SMILES: [Au]1234567[Au]89%10%11%12%13[Au]%14%15%16%171([Au]1%18%19%20%21%10[Au]%10%22%23%24%259[Au]9%26%27%2838[Au]38%29%30%312[Au]2%32%33%344%15[Au]4%15%35%36%141[Au]1%145%11%16%18%10932[Ag]2359%10%23%27%29[Au]%26([S]([Au]%112[Au]83([Ag]238%30%33%35%14%10[Au]%32([S]([Au]%102[Au]43([Ag]23%20%24%15198[Au]%19([S]([Au]12[Au]%2253([S]%25C23CC4CC(C2)CC(C4)C3)[S]1C12CC3CC(C1)CC(C3)C2)C12CC3CC(C1)CC(C3)C2)[S]%21C12CC3CC(C1)CC(C2)C3)([S]%36C12CC3CC(C1)CC(C2)C3)[S]%10C12CC3CC(C1)CC(C3)C2)C12CC3CC(C1)CC(C2)C3)[S]%34C12CC3CC(C1)CC(C3)C2)([S]%31C12CC3CC(C1)CC(C3)C2)[S]%11C12CC3CC(C1)CC(C2)C3)C12CC3CC(C1)CC(C3)C2)[S]%28C12CC3CC(C1)CC(C2)C3)[Ag]6%12([S]7C12CC3CC(C1)CC(C2)C3)([S]%13C12CC3CC(C1)CC(C2)C3)[S]%17C12CC3CC(C1)CC(C2)C3
• Title of publication: A Correlated Series of Au/Ag Nanoclusters Revealing the Evolutionary Patterns of Asymmetric Ag Doping.
• Authors of publication: Li, Yingwei; Luo, Tian-Yi; Zhou, Meng; Song, Yongbo; Rosi, Nathaniel L.; Jin, Rongchao
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 43
• Pages of publication: 14235 - 14243
• a: 17.4011 ± 0.0006 Å
• b: 44.214 ± 0.002 Å
• c: 30.335 ± 0.0013 Å
• α: 90°
• β: 93.106 ± 0.003°
• γ: 90°
• Cell volume: 23304.6 ± 1.7 ų
• Cell temperature: 230 ± 2 K
• Ambient diffraction temperature: 230.01 K
• Number of distinct elements: 5
• 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: 0.1494
• Residual factor for significantly intense reflections: 0.1317
• Weighted residual factors for significantly intense reflections: 0.3186
• Weighted residual factors for all reflections included in the refinement: 0.3306
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No