Information card for entry 4339119

Structure parameters

• Formula: C48 H110 Br4 O38 U3
• Calculated formula: C48 H110 Br4 O38 U3
• Title of publication: Speciation of uranyl complexes in ionic liquids by optical spectroscopy.
• Authors of publication: Nockemann, Peter; Servaes, Kelly; Van Deun, Rik; Van Hecke, Kristof; Van Meervelt, Luc; Binnemans, Koen; Görller-Walrand, Christiane
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 26
• Pages of publication: 11335 - 11344
• a: 12.1149 ± 0.0009 Å
• b: 17.6649 ± 0.0011 Å
• c: 17.7492 ± 0.001 Å
• α: 90°
• β: 99.113 ± 0.004°
• γ: 90°
• Cell volume: 3750.5 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0773
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.1058
• Weighted residual factors for all reflections included in the refinement: 0.1166
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No