Information card for entry 7040262

Structure parameters

• Formula: C166.5 H162 B4 Cl4 N24 O4 Ru4
• Calculated formula: C166.5 H162 B4 Cl4 N24 O4 Ru4
• Title of publication: Ruthenium(ii) complexes of hemilabile pincer ligands: synthesis and catalysing the transfer hydrogenation of ketones.
• Authors of publication: Nair, Ashwin G.; McBurney, Roy T.; Walker, D. Barney; Page, Michael J.; Gatus, Mark R. D.; Bhadbhade, Mohan; Messerle, Barbara A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 36
• Pages of publication: 14335 - 14342
• a: 16.8274 ± 0.0012 Å
• b: 18.3619 ± 0.0015 Å
• c: 24.387 ± 0.002 Å
• α: 74.808 ± 0.004°
• β: 89.916 ± 0.004°
• γ: 81.797 ± 0.004°
• Cell volume: 7192.3 ± 1 ų
• Cell temperature: 150.01 K
• Ambient diffraction temperature: 150.01 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: 0.1364
• Residual factor for significantly intense reflections: 0.0889
• Weighted residual factors for significantly intense reflections: 0.2086
• Weighted residual factors for all reflections included in the refinement: 0.2371
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No