Information card for entry 4132101

Structure parameters

• Common name: Ru-PD
• Formula: C11 H19 Cl N O9 Ru2
• Calculated formula: C11 H19 Cl N O9 Ru2
• SMILES: [Ru]1234([Ru]([O]=C(O1)C)(OC(=[O]2)C)(OC(=[O]3)C)([O]=C(O4)C)[O]=CN(C)C)Cl
• Title of publication: Electron Injection from Photoexcited Metal-Organic Framework Ligands to Ru₂ Secondary Building Units for Visible-Light-Driven Hydrogen Evolution.
• Authors of publication: Lan, Guangxu; Zhu, Yuan-Yuan; Veroneau, Samuel S.; Xu, Ziwan; Micheroni, Daniel; Lin, Wenbin
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 16
• Pages of publication: 5326 - 5329
• a: 8.1385 ± 0.0002 Å
• b: 11.9075 ± 0.0004 Å
• c: 18.1107 ± 0.0006 Å
• α: 90°
• β: 95.295 ± 0.001°
• γ: 90°
• Cell volume: 1747.6 ± 0.09 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 6
• 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: 0.028
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.0744
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.41328 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No