Information card for entry 7054811

Structure parameters

• Common name: 2THF
• Formula: C38 H68 O P Si2 U
• Calculated formula: C38 H68 O P Si2 U
• Title of publication: Activation of carbon dioxide by new mixed sandwich uranium(iii) complexes incorporating cyclooctatetraenyl and pyrrolide, phospholide, or arsolide ligands
• Authors of publication: Kahan, Rachel J.; Cloke, F. Geoffrey N.; Roe, S. Mark; Nief, François
• Journal of publication: New J. Chem.
• Year of publication: 2015
• Journal volume: 39
• Journal issue: 10
• Pages of publication: 7602
• a: 11.8847 ± 0.0007 Å
• b: 14.9475 ± 0.0008 Å
• c: 22.5236 ± 0.0014 Å
• α: 90°
• β: 89.568 ± 0.005°
• γ: 90°
• Cell volume: 4001.1 ± 0.4 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0429
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0641
• Weighted residual factors for all reflections included in the refinement: 0.07
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo/Ka
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No