Information card for entry 4306540

Structure parameters

• Formula: C24 H24 Cl F6 N2 O P Ru
• Calculated formula: C24 H24 Cl F6 N2 O P Ru
• SMILES: [Ru]123456(Cl)([cH]7[cH]1[cH]2[c]13[c]4([cH]57)CC2=C(C1)CC=CC2)[n]1ccccc1c1cccc[n]61.O.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: The Contrasting Chemistry and Cancer Cell Cytotoxicity of Bipyridine and Bipyridinediol Ruthenium(II) Arene Complexes
• Authors of publication: Tijana Bugarcic; Abraha Habtemariam; Jana Stepankova; Pavla Heringova; Jana Kasparkova; Robert J. Deeth; Russell D. L. Johnstone; Alessandro Prescimone; Andrew Parkin; Simon Parsons; Viktor Brabec; Peter J. Sadler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 11470 - 11486
• a: 7.4422 ± 0.0003 Å
• b: 11.8685 ± 0.0005 Å
• c: 13.7805 ± 0.0006 Å
• α: 94.96 ± 0.002°
• β: 101.341 ± 0.002°
• γ: 91.58 ± 0.002°
• Cell volume: 1187.73 ± 0.09 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.044
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for all reflections: 0.0868
• Weighted residual factors for significantly intense reflections: 0.0806
• Weighted residual factors for all reflections included in the refinement: 0.0868
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9159
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No