Information card for entry 4307847

Structure parameters

• Formula: C23 H28 Cl F6 N4 Os P
• Calculated formula: C23 H28 Cl F6 N4 Os P
• SMILES: [Os]123456(Cl)([N](=Nc7[n]1cccc7)c1ccc(N(C)C)cc1)[c]1([cH]6[cH]5[c]4([cH]3[cH]21)C)C(C)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Chloro Half-Sandwich Osmium(II) Complexes: Influence of Chelated N,N-Ligands on Hydrolysis, Guanine Binding, and Cytotoxicity
• Authors of publication: Anna F. A. Peacock; Abraha Habtemariam; Stephen A. Moggach; Alessandro Prescimone; Simon Parsons; Peter J. Sadler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 4049 - 4059
• a: 8.2549 ± 0.0003 Å
• b: 12.2787 ± 0.0004 Å
• c: 12.8556 ± 0.0005 Å
• α: 84.792 ± 0.002°
• β: 82.98 ± 0.002°
• γ: 80.68 ± 0.002°
• Cell volume: 1272.84 ± 0.08 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.0309
• Residual factor for significantly intense reflections: 0.0285
• Weighted residual factors for all reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.0644
• Weighted residual factors for all reflections included in the refinement: 0.065
• Goodness-of-fit parameter for all reflections included in the refinement: 0.6645
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No