Information card for entry 7125708

Structure parameters

• Formula: C55 H82 N6 O2 U
• Calculated formula: C55 H82 N6 O2 U
• Title of publication: CO₂ conversion to phenyl isocyanates by uranium(vi) bis(imido) complexes.
• Authors of publication: Maria, Leonor; Bandeira, Nuno A. G.; Marçalo, Joaquim; Santos, Isabel C.; Gibson, John K.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 3
• Pages of publication: 431 - 434
• a: 13.3531 ± 0.0007 Å
• b: 13.9911 ± 0.0006 Å
• c: 16.8717 ± 0.0009 Å
• α: 103.238 ± 0.003°
• β: 108.535 ± 0.002°
• γ: 108.528 ± 0.003°
• Cell volume: 2635.8 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0826
• Residual factor for significantly intense reflections: 0.0577
• Weighted residual factors for significantly intense reflections: 0.1396
• Weighted residual factors for all reflections included in the refinement: 0.1496
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No