Information card for entry 7107261

Structure parameters

• Chemical name: Uranyl(VI) Ar2NacNac Bis(N-MeIm) Iron(II) chloride MeIm
• Formula: C45 H67 Cl Fe N8 O3 U
• Calculated formula: C45 H57 Cl Fe N8 O3 U
• Title of publication: Synthesis and reactivity of a uranyl-imidazolyl complex
• Authors of publication: Michael Schettini; Guang Wu; Trevor Hayton
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 1484
• a: 8.9781 ± 0.0009 Å
• b: 21.304 ± 0.002 Å
• c: 12.944 ± 0.0013 Å
• α: 90°
• β: 104.866 ± 0.002°
• γ: 90°
• Cell volume: 2392.9 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0502
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0829
• Weighted residual factors for all reflections included in the refinement: 0.0933
• Goodness-of-fit parameter for all reflections included in the refinement: 0.781
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No