Information card for entry 4128661

Structure parameters

• Formula: C16 H36 N O9 P3 Si0.5
• Calculated formula: C16 H36 N O9 P3 Si0.5
• Title of publication: Orthophosphate and Sulfate Utilization for C-E (E = P, S) Bond Formation via Trichlorosilyl Phosphide and Sulfide Anions.
• Authors of publication: Geeson, Michael B.; Ríos, Pablo; Transue, Wesley J.; Cummins, Christopher C.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 15
• Pages of publication: 6375 - 6384
• a: 13.1805 ± 0.0017 Å
• b: 18.929 ± 0.002 Å
• c: 19.042 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4750.9 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.0801
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.089
• Weighted residual factors for all reflections included in the refinement: 0.1027
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No