Information card for entry 7128206

Structure parameters

• Formula: C44 H70 Li N4 P7 Si2
• Calculated formula: C44 H70 Li N4 P7 Si2
• Title of publication: Fragmentation, catenation, and direct functionalisation of white phosphorus by a uranium(IV)-silyl-phosphino-carbene complex.
• Authors of publication: Boronski, Josef T.; Seed, John A.; Wooles, Ashley J.; Liddle, Stephen T.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 41
• Pages of publication: 5090 - 5093
• a: 9.9343 ± 0.0004 Å
• b: 23.4616 ± 0.0011 Å
• c: 22.0737 ± 0.0012 Å
• α: 90°
• β: 91.875 ± 0.005°
• γ: 90°
• Cell volume: 5142.1 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0993
• Residual factor for significantly intense reflections: 0.0686
• Weighted residual factors for significantly intense reflections: 0.1798
• Weighted residual factors for all reflections included in the refinement: 0.201
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No