Information card for entry 4003685

Structure parameters

• Formula: Ce38 O33.33
• Calculated formula: Ce38 O33.3332
• Title of publication: Supramolecular Porous Assemblies of Atomically Precise Catalytically Active Cerium-Based Clusters
• Authors of publication: Wasson, Megan C.; Zhang, Xuan; Otake, Ken-ichi; Rosen, Andrew S.; Alayoglu, Selim; Krzyaniak, Matthew D.; Chen, Zhijie; Redfern, Louis R.; Robison, Lee; Son, Florencia A.; Chen, Yongwei; Islamoglu, Timur; Notestein, Justin M.; Snurr, Randall Q.; Wasielewski, Michael R.; Farha, Omar K.
• Journal of publication: Chemistry of Materials
• Year of publication: 2020
• a: 25.1726 ± 0.0018 Å
• b: 25.1726 ± 0.0018 Å
• c: 36.76 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 23293 ± 3 ų
• Cell temperature: 250 K
• Ambient diffraction temperature: 250 K
• Number of distinct elements: 2
• Space group number: 86
• Hermann-Mauguin space group symbol: P 42/n :2
• Hall space group symbol: -P 4bc
• Residual factor for all reflections: 0.4172
• Residual factor for significantly intense reflections: 0.3723
• Weighted residual factors for significantly intense reflections: 0.7872
• Weighted residual factors for all reflections included in the refinement: 0.8067
• Goodness-of-fit parameter for all reflections included in the refinement: 3.644
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No