Information card for entry 4303327

Structure parameters

• Formula: C16 H22 Cl F6 N2 P Ru
• Calculated formula: C16 H22 Cl F6 N2 P Ru
• SMILES: [Ru]123456(Cl)([c]7([cH]1[cH]2[c]3([cH]4[cH]57)C(C)C)C)[NH2]c1c([NH2]6)cccc1.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Ruthenium(II) Arene Anticancer Complexes with Redox-Active Diamine Ligands
• Authors of publication: Tijana Bugarcic; Abraha Habtemariam; Robert J. Deeth; Francesca P. A. Fabbiani; Simon Parsons; Peter J. Sadler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 9444 - 9453
• a: 10.6876 ± 0.0004 Å
• b: 17.0748 ± 0.0008 Å
• c: 10.8625 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1982.28 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0418
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0811
• Weighted residual factors for all reflections included in the refinement: 0.0838
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No