Information card for entry 4303328

Structure parameters

• Formula: C18 H24 Cl F6 N2 P Ru
• Calculated formula: C18 H24 Cl F6 N2 P Ru
• SMILES: F[P](F)(F)(F)(F)[F-].[c]12([c]3([c]4([c]5([c]6([c]1(C)[Ru]123456(Cl)[NH2]c2ccccc2[NH2]1)C)C)C)C)C
• 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: 12.7647 ± 0.0006 Å
• b: 10.891 ± 0.0005 Å
• c: 15.8629 ± 0.0007 Å
• α: 90°
• β: 113.431 ± 0.003°
• γ: 90°
• Cell volume: 2023.42 ± 0.17 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0855
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for all reflections: 0.0919
• Weighted residual factors for significantly intense reflections: 0.0803
• Weighted residual factors for all reflections included in the refinement: 0.0919
• Goodness-of-fit parameter for all reflections included in the refinement: 0.6003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No