Information card for entry 1548332

Structure parameters

• Formula: C84 H134 Au0.79 Cl3.36 K O92
• Calculated formula: C84 H134 Au0.786 Cl3.3586 K O92
• Title of publication: Selective isolation of gold facilitated by second-sphere coordination with alpha-cyclodextrin
• Authors of publication: Zhichang Liu; Marco Frasconi; Juying Lei; Zachary J. Brown; Zhixue Zhu; Dennis Cao; Julien Iehl; Guoliang Liu; Albert C. Fahrenbach; Youssry Y. Botros; Omar K. Farha; Joseph T. Hupp; Chad A. Mirkin; J. Fraser Stoddart
• Journal of publication: Nature Communications
• Year of publication: 2013
• Journal volume: 4
• Pages of publication: 1855
• a: 15.7337 ± 0.0003 Å
• b: 24.3445 ± 0.0005 Å
• c: 19.2645 ± 0.0004 Å
• α: 90°
• β: 108.748 ± 0.001°
• γ: 90°
• Cell volume: 6987.4 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0618
• Residual factor for significantly intense reflections: 0.0601
• Weighted residual factors for significantly intense reflections: 0.1614
• Weighted residual factors for all reflections included in the refinement: 0.163
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No