Information card for entry 4126599

Structure parameters

• Formula: C90 H198 Ge18 K2 N4 O12 Pd3 Si6
• Calculated formula: C90 H198 Ge18 K2 N4 O12 Pd3 Si6
• Title of publication: Eclipsed- and Staggered-[Ge18Pd3{E(i)Pr3}6](2-) (E = Si, Sn): Positional Isomerism in Deltahedral Zintl Clusters.
• Authors of publication: Perla, Luis G.; Muñoz-Castro, Alvaro; Sevov, Slavi C.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• a: 16.1039 ± 0.0006 Å
• b: 17.0961 ± 0.0006 Å
• c: 27.6983 ± 0.001 Å
• α: 95.184 ± 0.002°
• β: 91.202 ± 0.003°
• γ: 117.634 ± 0.002°
• Cell volume: 6711.1 ± 0.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120.02 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0809
• Residual factor for significantly intense reflections: 0.0587
• Weighted residual factors for significantly intense reflections: 0.1499
• Weighted residual factors for all reflections included in the refinement: 0.1661
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No