Information card for entry 7712856

Structure parameters

• Formula: C136 H88 N16 Pd4
• Calculated formula: C136 H88 N16 Pd4
• Title of publication: Construction of Pd-based coordination cages with three geometrically distinct ligands.
• Authors of publication: Li, Ru-Jin; de Montmollin, Jean; Fadaei-Tirani, Farzaneh; Scopelliti, Rosario; Severin, Kay
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• a: 19.4282 ± 0.0007 Å
• b: 21.0392 ± 0.0005 Å
• c: 24.7683 ± 0.0006 Å
• α: 91.918 ± 0.002°
• β: 109.85 ± 0.003°
• γ: 91.61 ± 0.002°
• Cell volume: 9508.9 ± 0.5 ų
• Cell temperature: 140 ± 0.1 K
• Ambient diffraction temperature: 140 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1428
• Residual factor for significantly intense reflections: 0.1177
• Weighted residual factors for significantly intense reflections: 0.3805
• Weighted residual factors for all reflections included in the refinement: 0.4032
• Goodness-of-fit parameter for all reflections included in the refinement: 1.671
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No