Information card for entry 7025589

Structure parameters

• Formula: C47 H68 F2 O U2
• Calculated formula: C40 H60 F2 O U2
• SMILES: [U]12345678(F)(O[U]9%10%11%12%13%14%15%16(F)([c]%17([c]9([c]%10([c]%11([c]%12%17C)C)C)C)C)[c]9([c]%16([c]%15([c]%14([c]%139C)C)C)C)C)([c]9([c]1([c]2([c]3([c]49C)C)C)C)C)[c]1([c]5([c]6([c]7([c]81C)C)C)C)C
• Title of publication: Organometallic uranium(IV) fluoride complexes: preparation using protonolysis chemistry and reactivity with trimethylsilyl reagents.
• Authors of publication: Thomson, Robert K.; Graves, Christopher R.; Scott, Brian L.; Kiplinger, Jaqueline L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 29
• Pages of publication: 6826 - 6831
• a: 27.007 ± 0.003 Å
• b: 9.6398 ± 0.001 Å
• c: 17.0651 ± 0.0017 Å
• α: 90°
• β: 102.69 ± 0.001°
• γ: 90°
• Cell volume: 4334.2 ± 0.8 ų
• Cell temperature: 140 ± 1 K
• Ambient diffraction temperature: 140 ± 1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0406
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0644
• Weighted residual factors for all reflections included in the refinement: 0.0672
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No