Information card for entry 7024361

Structure parameters

• Formula: C31.5 H35 Cl N2 O2.5 Ru S
• Calculated formula: C31.5 H35 Cl N2 O2.5 Ru S
• Title of publication: Kinetic and structural studies on 'tethered' Ru(II) arene ketone reduction catalysts.
• Authors of publication: Cheung, Fung Kei Kathy; Clarke, Adam J.; Clarkson, Guy J.; Fox, David J.; Graham, Mark A.; Lin, Changxue; Crivillé, Adriana Lorente; Wills, Martin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 5
• Pages of publication: 1395 - 1402
• a: 7.0703 ± 0.0003 Å
• b: 11.9645 ± 0.0006 Å
• c: 34.9758 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2958.7 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0535
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.0826
• Weighted residual factors for all reflections included in the refinement: 0.0876
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No