Information card for entry 1559999

Structure parameters

• Chemical name: bis(triphenylphosphine)-tris(phenylthiolate)-bispalladium-ruthenium-hexafluoroantimoniate-dichloromethane
• Formula: C64.5 H59.5 Cl1.5 F6 P2 Pd2 Ru S3 Sb
• Calculated formula: C64.5 H59.5 Cl1.5 F6 P2 Pd2 Ru S3 Sb
• Title of publication: "Bottled" spiro-doubly aromatic trinuclear [Pd₂Ru]⁺ complexes.
• Authors of publication: Kulichenko, Maksim; Fedik, Nikita; Monfredini, Anna; Muñoz-Castro, Alvaro; Balestri, Davide; Boldyrev, Alexander I.; Maestri, Giovanni
• Journal of publication: Chemical science
• Year of publication: 2020
• Journal volume: 12
• Journal issue: 1
• Pages of publication: 477 - 486
• a: 11.9921 ± 0.0003 Å
• b: 12.28439 ± 0.00018 Å
• c: 21.733 ± 0.0005 Å
• α: 94.518 ± 0.0016°
• β: 91.0356 ± 0.0018°
• γ: 101.524 ± 0.0016°
• Cell volume: 3125.45 ± 0.12 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0541
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.1658
• Weighted residual factors for all reflections included in the refinement: 0.1659
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.7 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No