Information card for entry 7717766

Structure parameters

• Formula: C54 H76 Cl4 N6 O P2 Ru2
• Calculated formula: C54 H76 Cl4 N6 O P2 Ru2
• Title of publication: Ambient-pressure selective hydrogenation of unsaturated aldehydes and ketones into unsaturated alcohols in the water phase.
• Authors of publication: Wang, Tao; Li, Bin; Zhang, Yu; Xu, Shuting; Wang, Jun; Zheng, Jianwei; Li, Hao; Zhang, Fengjun; Fang, Xiaolong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 5
• Pages of publication: 1791 - 1796
• a: 11.2337 ± 0.0017 Å
• b: 11.6564 ± 0.0017 Å
• c: 11.8853 ± 0.0015 Å
• α: 88.336 ± 0.011°
• β: 89.35 ± 0.012°
• γ: 76.815 ± 0.013°
• Cell volume: 1514.6 ± 0.4 ų
• Cell temperature: 125 ± 30 K
• Ambient diffraction temperature: 125 ± 30 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1771
• Residual factor for significantly intense reflections: 0.1251
• Weighted residual factors for significantly intense reflections: 0.2891
• Weighted residual factors for all reflections included in the refinement: 0.3539
• Goodness-of-fit parameter for all reflections included in the refinement: 0.979
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No