Information card for entry 1574217

Structure parameters

• Formula: C128 H128 B2 F8 N22 O16 Pd Pt S2
• Calculated formula: C113 H93 B2 F8 N17 O11 Pd Pt S2
• Title of publication: Pd(μ-L)4Pt vs. Pd(μ-L)4RuCl2: chlorido ancillary ligands as defining factors in the host–guest interactions of M(μ-L)4M′ heterodimetallic supramolecular architectures
• Authors of publication: Gearing, Hayden B.; Cziferszky, Monika; Söhnel, Tilo; Wright, L. James; Crowley, James D.; Hartinger, Christian G.
• Journal of publication: Chemical Science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 17
• Pages of publication: 7294 - 7301
• a: 15.47952 ± 0.00019 Å
• b: 19.9749 ± 0.0003 Å
• c: 21.2142 ± 0.0003 Å
• α: 79.4685 ± 0.0011°
• β: 84.6071 ± 0.001°
• γ: 73.5233 ± 0.0011°
• Cell volume: 6177.96 ± 0.15 ų
• Cell temperature: 119.99 ± 0.13 K
• Ambient diffraction temperature: 119.99 ± 0.13 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0557
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1339
• Weighted residual factors for all reflections included in the refinement: 0.1371
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No