Information card for entry 1551438

Structure parameters

• Formula: C92 H114 Ag12 Br2 F12 N8 O8 S8
• Calculated formula: C90 H113 Ag12 Br F12 N8 O8 S8
• Title of publication: Hypersensitive dual-function luminescence switching of a silver-chalcogenolate cluster-based metal-organic framework
• Authors of publication: Ren-Wu Huang; Yong-Sheng Wei; Xi-Yan Dong; Xiao-Hui Wu; Chen-Xia Du; Shuang-Quan Zang; Thomas C. W. Mak
• Journal of publication: Nature Chemistry
• Year of publication: 2017
• Journal volume: 9
• Pages of publication: 689 - 697
• a: 17.2292 ± 0.0003 Å
• b: 17.2292 ± 0.0003 Å
• c: 20.5453 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6098.8 ± 0.3 ų
• Cell temperature: 100.15 ± 0.1 K
• Ambient diffraction temperature: 100.15 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 121
• Hermann-Mauguin space group symbol: I -4 2 m
• Hall space group symbol: I -4 2
• Residual factor for all reflections: 0.059
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.0939
• Weighted residual factors for all reflections included in the refinement: 0.1008
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No