Information card for entry 7046238

Structure parameters

• Formula: C90 H104 B4 I2 N29 S10 U2
• Calculated formula: C90 H104 B4 I2 N29 S10 U2
• Title of publication: Uranium(iii) complexes supported by hydrobis(mercaptoimidazolyl)borates: synthesis and oxidation chemistry.
• Authors of publication: Maria, Leonor; Santos, Isabel C.; Santos, Isabel
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 31
• Pages of publication: 10601 - 10612
• a: 10.7351 ± 0.0006 Å
• b: 16.1789 ± 0.0009 Å
• c: 17.9924 ± 0.001 Å
• α: 100.001 ± 0.002°
• β: 105.549 ± 0.002°
• γ: 103.819 ± 0.002°
• Cell volume: 2827.5 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0552
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.11
• Weighted residual factors for all reflections included in the refinement: 0.1139
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No