Information card for entry 7131026

Structure parameters

• Formula: C58.38 H44.5 Cl1.5 F15 N7 P2 Ru
• Calculated formula: C58.375 H44.5 Cl1.5 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: 17.5338 ± 0.0013 Å
• b: 19.1373 ± 0.0012 Å
• c: 20.747 ± 0.002 Å
• α: 107.594 ± 0.006°
• β: 98.679 ± 0.006°
• γ: 109.219 ± 0.004°
• Cell volume: 6018.8 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1827
• Residual factor for significantly intense reflections: 0.1497
• Weighted residual factors for significantly intense reflections: 0.45
• Weighted residual factors for all reflections included in the refinement: 0.4995
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• 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