Information card for entry 7117210

Structure parameters

• Chemical name: tris[4,4':2',2":4",4'"-quaterpyridine]ruthenium(II) bis(hexafluorophosphate) acetonitrile disolvate diethyl ether solvate
• Formula: C67.99 H56.99 F11.99 N14 O P2 Ru
• Calculated formula: C67.992 H56.985 F11.988 N13.998 O0.999 P1.998 Ru
• Title of publication: Red-light-driven photocatalytic hydrogen evolution using a ruthenium quaterpyridine complex
• Authors of publication: E. Rousset; D. Chartrand; I. Ciofini; V. Marvaud; G. S. Hanan
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 9261
• a: 17.6408 ± 0.0012 Å
• b: 17.6408 ± 0.0012 Å
• c: 44.355 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 11953.9 ± 1.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 7
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.1188
• Residual factor for significantly intense reflections: 0.0872
• Weighted residual factors for significantly intense reflections: 0.2204
• Weighted residual factors for all reflections included in the refinement: 0.2673
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No