Information card for entry 1515664

Structure parameters

• Formula: C57 H162 N9 O3 Si18 U3
• Calculated formula: C57 H162 N9 O3 Si18 U3
• Title of publication: Carbon monoxide coupling and functionalisation at a simple uranium coordination complex
• Authors of publication: Arnold, Polly L.; Turner, Zoë R.; Bellabarba, Ronan M.; Tooze, Robert P.
• Journal of publication: Chemical Science
• Year of publication: 2011
• Journal volume: 2
• Journal issue: 1
• Pages of publication: 77
• a: 30.0251 ± 0.0006 Å
• b: 15.6531 ± 0.0003 Å
• c: 22.4759 ± 0.0004 Å
• α: 90°
• β: 103.691 ± 0.002°
• γ: 90°
• Cell volume: 10263.2 ± 0.3 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 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: 0.1118
• Residual factor for significantly intense reflections: 0.0654
• Weighted residual factors for significantly intense reflections: 0.164
• Weighted residual factors for all reflections included in the refinement: 0.1752
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No