Information card for entry 7715982

Structure parameters

• Chemical name: [Li([12]crown-4)2][1,2,3-P3C2tBu2].(C4H8O)
• Formula: C30 H58 Li O9 P3
• Calculated formula: C28 H54 Li O8.5 P3
• Title of publication: Access to 1,2,3-triphospholide ligands by reduction of di-<i>tert</i>-butyldiphosphatetrahedrane.
• Authors of publication: Uttendorfer, Maria K.; Hierlmeier, Gabriele; Balázs, Gábor; Wolf, Robert
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 24
• Pages of publication: 10113 - 10119
• a: 37.25924 ± 0.00016 Å
• b: 12.33778 ± 0.00005 Å
• c: 31.13083 ± 0.00016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14310.7 ± 0.11 ų
• Cell temperature: 123 ± 0.1 K
• Ambient diffraction temperature: 123 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0461
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.1143
• Weighted residual factors for all reflections included in the refinement: 0.1178
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No