Information card for entry 4121595

Structure parameters

• Formula: C40 H33 F12 N7 P2 Ru
• Calculated formula: C40 H30 F12 N7 P2 Ru
• Title of publication: Visible light-driven hydrogen evolution from water catalyzed by a molecular cobalt complex.
• Authors of publication: Tong, Lianpeng; Zong, Ruifa; Thummel, Randolph P.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 13
• Pages of publication: 4881 - 4884
• a: 10.7899 ± 0.0002 Å
• b: 13.6545 ± 0.0003 Å
• c: 13.9861 ± 0.0002 Å
• α: 80.6099 ± 0.0011°
• β: 89.009 ± 0.0011°
• γ: 78.5251 ± 0.0012°
• Cell volume: 1992.09 ± 0.06 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0467
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.1024
• Weighted residual factors for all reflections included in the refinement: 0.1058
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No