Information card for entry 4121469

Structure parameters

• Formula: C33 H57 O4 P2 Ru
• Calculated formula: C33 H57 O4 P2 Ru
• Title of publication: Ruthenium-catalyzed reduction of carbon dioxide to formaldehyde.
• Authors of publication: Bontemps, Sébastien; Vendier, Laure; Sabo-Etienne, Sylviane
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 11
• Pages of publication: 4419 - 4425
• a: 13.2848 ± 0.0002 Å
• b: 13.6995 ± 0.0005 Å
• c: 18.5567 ± 0.0003 Å
• α: 90°
• β: 101.855 ± 0.002°
• γ: 90°
• Cell volume: 3305.19 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.1072
• Residual factor for significantly intense reflections: 0.0948
• Weighted residual factors for significantly intense reflections: 0.2438
• Weighted residual factors for all reflections included in the refinement: 0.2564
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No