Information card for entry 4132102

Structure parameters

• Formula: C51 H31 N5 O11 Ru3
• Calculated formula: C51 H31 N5 O11 Ru3
• 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: 8.7321 ± 0.0011 Å
• b: 21.947 ± 0.003 Å
• c: 22.807 ± 0.003 Å
• α: 90.743 ± 0.002°
• β: 93.98 ± 0.003°
• γ: 92.211 ± 0.003°
• Cell volume: 4356.5 ± 1 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1599
• Residual factor for significantly intense reflections: 0.1478
• Weighted residual factors for significantly intense reflections: 0.4131
• Weighted residual factors for all reflections included in the refinement: 0.4295
• Goodness-of-fit parameter for all reflections included in the refinement: 1.864
• Diffraction radiation wavelength: 0.41328 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No