Information card for entry 1558865

Structure parameters

• Formula: C30 H54 Au3 Co2 N6 Na3.33 O28 S6
• Calculated formula: C30 H54 Au3 Co2 N6 Na3.33327 O28.0001 S6
• Title of publication: Self-assembly of Cyclic Hexamers of γ-Cyclodextrin in a Metallosupramolecular Framework with D-Penicillamine
• Authors of publication: Somsri, Supattra; Kuwamura, Naoto; Kojima, Tatsuhiro; Yoshinari, Nobuto; Konno, Takumi
• Journal of publication: Chemical Science
• Year of publication: 2020
• a: 39.2235 ± 0.0011 Å
• b: 39.2235 ± 0.0011 Å
• c: 39.2235 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 60345 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 220
• Hermann-Mauguin space group symbol: I -4 3 d
• Hall space group symbol: I -4bd 2c 3
• Residual factor for all reflections: 0.0215
• Residual factor for significantly intense reflections: 0.0213
• Weighted residual factors for significantly intense reflections: 0.0545
• Weighted residual factors for all reflections included in the refinement: 0.0548
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.4248 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No