Information card for entry 4517404

Structure parameters

• Formula: C12 H12 Cl4 O14 U
• Calculated formula: C12 H12 Cl4 O14 U
• Title of publication: A Redox-Innocent Uranium(IV)-Quinoid Metal-Organic Framework.
• Authors of publication: Refn, Vanja E.; Kubus, Mariusz; Mossin, Susanne; Larsen, René Wugt; Pedersen, Kasper S.
• Journal of publication: ACS omega
• Year of publication: 2020
• Journal volume: 5
• Journal issue: 7
• Pages of publication: 3462 - 3466
• a: 13.8598 ± 0.0007 Å
• b: 11.496 ± 0.0006 Å
• c: 12.61 ± 0.0006 Å
• α: 90°
• β: 96.415 ± 0.005°
• γ: 90°
• Cell volume: 1996.6 ± 0.17 ų
• Cell temperature: 285 ± 13 K
• Ambient diffraction temperature: 285 ± 13 K
• Number of distinct elements: 5
• 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: 0.0221
• Residual factor for significantly intense reflections: 0.02
• Weighted residual factors for significantly intense reflections: 0.0434
• Weighted residual factors for all reflections included in the refinement: 0.0445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No