Information card for entry 7712370

Structure parameters

• Formula: Ba2 Ce H2 I8 O25
• Calculated formula: Ba2 Ce H2 I8 O25
• Title of publication: A new polar alkaline earth−rare earth−iodate, Ba2Ce(IO3)8(H2O)
• Authors of publication: Zhang, Xue-Ying; Zhang, Xiao-Han; Yang, Bing-Ping; Mao, Jiang-Gao
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 15.5042 ± 0.0005 Å
• b: 7.8841 ± 0.0003 Å
• c: 19.5359 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2388 ± 0.15 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0277
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for significantly intense reflections: 0.0527
• Weighted residual factors for all reflections included in the refinement: 0.0548
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No