Information card for entry 7705226

Structure parameters

• Formula: C34 H23 F6 N4 O3 P Ru
• Calculated formula: C34 H23 F6 N4 O3 P Ru
• SMILES: [Ru]123([O]=C4c5c(O1)cccc5C(=O)c1ccccc41)([n]1c(cccc1)c1[n]2cccc1)[n]1c(cccc1)c1[n]3cccc1.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Hydrogen peroxide assisted photorelease of an anthraquinone-based ligand from [Ru(2,2'-bipyridine)₂(9,10-dioxo-9,10-dihydroanthracen-1-olate)]Cl in aqueous solution.
• Authors of publication: Zeng, L.; Sirbu, D.; Waddell, P. G.; Tkachenko, N. V.; Probert, M. R.; Benniston, A. C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 38
• Pages of publication: 13243 - 13252
• a: 7.61 ± 0.002 Å
• b: 13.099 ± 0.004 Å
• c: 19.064 ± 0.006 Å
• α: 101.261 ± 0.005°
• β: 96.918 ± 0.005°
• γ: 96.3 ± 0.005°
• Cell volume: 1832.8 ± 0.9 ų
• Cell temperature: 100 ± 0.2 K
• Ambient diffraction temperature: 100 ± 0.2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1
• Residual factor for significantly intense reflections: 0.0788
• Weighted residual factors for significantly intense reflections: 0.2087
• Weighted residual factors for all reflections included in the refinement: 0.2228
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.6889 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No