Information card for entry 7126066

Structure parameters

• Formula: C94 H46 Ag11.96 Cu F36 N12
• Calculated formula: C94 H46 Ag12.046 Cu0.902 F36 N12
• Title of publication: Unexpected structural transformation into noria-like Ag₁₃ metal clusters and a copper-doping induced boost in photoluminescence.
• Authors of publication: Peng, Su-Kao; Lu, Zhou; Xie, Mo; Huang, Yong-Liang; Luo, Dong; Wang, Jia-Nan; Zhu, Xiao-Wei; Li, Xue; Zhou, Xiao-Ping; Li, Dan
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 35
• Pages of publication: 4789 - 4792
• a: 15.5019 ± 0.0004 Å
• b: 15.7093 ± 0.0004 Å
• c: 15.9495 ± 0.0006 Å
• α: 60.608 ± 0.003°
• β: 65.701 ± 0.003°
• γ: 61.289 ± 0.003°
• Cell volume: 2888.52 ± 0.18 ų
• Cell temperature: 100 ± 10 K
• Ambient diffraction temperature: 100 ± 10 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0955
• Residual factor for significantly intense reflections: 0.0876
• Weighted residual factors for significantly intense reflections: 0.2459
• Weighted residual factors for all reflections included in the refinement: 0.2533
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No