Information card for entry 7062758

Structure parameters

• Formula: C25 H40 Cl6 Ir2 N2 O9 Ru2
• Calculated formula: C25 H40 Cl6 Ir2 N2 O9 Ru2
• Title of publication: Heterometallic Ru–Ir carbonyl clusters as catalyst precursors for hydrogenation and hydrogen transfer reactions
• Authors of publication: Forti, Francesca; Cesari, Cristiana; Bortoluzzi, Marco; Femoni, Cristina; Iapalucci, Maria Carmela; Zacchini, Stefano
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 41
• Pages of publication: 19289 - 19303
• a: 15.1802 ± 0.0011 Å
• b: 17.3645 ± 0.0013 Å
• c: 15.3305 ± 0.0012 Å
• α: 90°
• β: 104.418 ± 0.002°
• γ: 90°
• Cell volume: 3913.8 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0314
• Residual factor for significantly intense reflections: 0.0295
• Weighted residual factors for significantly intense reflections: 0.0583
• Weighted residual factors for all reflections included in the refinement: 0.0588
• Goodness-of-fit parameter for all reflections included in the refinement: 1.237
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No