Information card for entry 7717380

Structure parameters

• Formula: C51 H62 Li N9 O2 U
• Calculated formula: C51 H62 Li N9 O2 U
• Title of publication: Controlled and sequential single-electron reduction of the uranyl dication.
• Authors of publication: Obey, Tom J. N.; Nichol, Gary S.; Love, Jason B.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 39
• Pages of publication: 16229 - 16240
• a: 18.322 ± 0.0007 Å
• b: 13.2763 ± 0.0004 Å
• c: 20.5072 ± 0.0009 Å
• α: 90°
• β: 108.143 ± 0.004°
• γ: 90°
• Cell volume: 4740.3 ± 0.3 ų
• Cell temperature: 119.99 ± 0.11 K
• Ambient diffraction temperature: 119.99 ± 0.11 K
• Number of distinct elements: 6
• 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: 0.0611
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.0594
• Weighted residual factors for all reflections included in the refinement: 0.0641
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No