Information card for entry 2217006

Structure parameters

• Chemical name: Bis(nonafluorobutanesulfonato-κO)dioxidotris(tetrahydrofuran-κO)uranium(VI)
• Formula: C20 H24 F18 O11 S2 U
• Calculated formula: C20 H24 F18 O11 S2 U
• SMILES: C(C(C(C(F)(F)F)(F)F)(F)F)(F)(F)S(=O)(=O)O[U]([O]1CCCC1)(=O)(=O)(OS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)([O]1CCCC1)[O]1CCCC1
• Title of publication: Bis(nonafluorobutanesulfonato-κ<i>O</i>)dioxidotris(tetrahydrofuran-κ<i>O</i>)uranium(VI)
• Authors of publication: Takao, Koichiro; Ikeda, Yasuhisa
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: m168 - m168
• a: 23.803 ± 0.012 Å
• b: 11.197 ± 0.005 Å
• c: 12.919 ± 0.005 Å
• α: 90°
• β: 101.46 ± 0.04°
• γ: 90°
• Cell volume: 3375 ± 3 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0505
• Residual factor for significantly intense reflections: 0.0455
• Weighted residual factors for significantly intense reflections: 0.1219
• Weighted residual factors for all reflections included in the refinement: 0.1248
• Goodness-of-fit parameter for all reflections included in the refinement: 1.132
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes