Information card for entry 7131027

Structure parameters

• Formula: C63.95 H48.22 Cl0.65 F15 N7 P2 Ru
• Calculated formula: C63.9511 H48.2244 Cl0.654 F15 N7 P2 Ru
• Title of publication: Accessing unsymmetrical Ru(II) bipyridine complexes: a versatile synthetic mechanism for fine tuning photophysical properties.
• Authors of publication: Hallen, Lukas; Horan, Alexandra M.; Twamley, Brendan; McGarrigle, Eoghan M.; Draper, Sylvia M.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 3
• Pages of publication: 330 - 333
• a: 18.3727 ± 0.0008 Å
• b: 23.3211 ± 0.001 Å
• c: 31.2846 ± 0.0012 Å
• α: 90°
• β: 105.648 ± 0.002°
• γ: 90°
• Cell volume: 12907.7 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1326
• Residual factor for significantly intense reflections: 0.0901
• Weighted residual factors for significantly intense reflections: 0.2511
• Weighted residual factors for all reflections included in the refinement: 0.2935
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No