Information card for entry 1568222

Structure parameters

• Formula: C320 H480 Cu75 S32
• Calculated formula: C320 H480 Cu75 S32
• Title of publication: High-nuclearity and thiol protected core-shell [Cu₇₅(S-Adm)₃₂]²⁺: distorted octahedra fixed to Cu₁₅ core <i>via</i> strong cuprophilic interactions.
• Authors of publication: Tang, Jie; Liu, Chong; Zhu, Chenyu; Sun, Keju; Wang, He; Yin, Wen; Xu, Chuting; Li, Yang; Wang, Weiguo; Wang, Li; Wu, Renan; Liu, Chao; Huang, Jiahui
• Journal of publication: Nanoscale
• Year of publication: 2023
• Journal volume: 15
• Journal issue: 6
• Pages of publication: 2843 - 2848
• a: 23.6279 ± 0.0005 Å
• b: 23.6779 ± 0.0005 Å
• c: 23.8819 ± 0.0005 Å
• α: 112.131 ± 0.001°
• β: 119.538 ± 0.001°
• γ: 92.924 ± 0.001°
• Cell volume: 10292.9 ± 0.4 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.251
• Residual factor for significantly intense reflections: 0.1854
• Weighted residual factors for significantly intense reflections: 0.453
• Weighted residual factors for all reflections included in the refinement: 0.5012
• Goodness-of-fit parameter for all reflections included in the refinement: 1.594
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No