Information card for entry 7719851

Structure parameters

• Formula: C2 H12 F2 N2 O7 P2 Zr
• Calculated formula: C2 H12 F2 N2 O7 P2 Zr
• Title of publication: Syntheses, crystal structures, and proton conduction properties of two zirconium fluorophosphonates
• Authors of publication: Liu, Shu-Zhen; Zhao, Ying-Ying; Ren, Yu-Wei; Chen, Ziyuan; Yang, Lu; Chen, Zhi-Hua; Wei, Zhongxin; Sun, Hai-Yan; Feng, Mei-Ling; Huang, Xiao-Ying
• Journal of publication: Dalton Transactions
• Year of publication: 2025
• a: 7.9239 ± 0.0002 Å
• b: 10.255 ± 0.0003 Å
• c: 14.1277 ± 0.0004 Å
• α: 90°
• β: 103.384 ± 0.003°
• γ: 90°
• Cell volume: 1116.83 ± 0.06 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0349
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.088
• Weighted residual factors for all reflections included in the refinement: 0.0895
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No