Information card for entry 7014411

Structure parameters

• Formula: C22 H30 Cl N O Ru
• Calculated formula: C22 H30 Cl N O Ru
• SMILES: CCC[N]1=Cc2ccccc2O[Ru]234561([c]1([c]2([c]3([c]4([c]5([c]61C)C)C)C)C)C)Cl
• Title of publication: Antiproliferative activity of chelating N,O- and N,N-ruthenium(II) arene functionalised poly(propyleneimine) dendrimer scaffolds.
• Authors of publication: Govender, Preshendren; Renfrew, Anna K.; Clavel, Catherine M.; Dyson, Paul J.; Therrien, Bruno; Smith, Gregory S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 5
• Pages of publication: 1158 - 1167
• a: 7.62 ± 0.002 Å
• b: 21.34 ± 0.004 Å
• c: 12.83 ± 0.003 Å
• α: 90°
• β: 99.67 ± 0.03°
• γ: 90°
• Cell volume: 2056.7 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.2884
• Residual factor for significantly intense reflections: 0.1373
• Weighted residual factors for significantly intense reflections: 0.3016
• Weighted residual factors for all reflections included in the refinement: 0.3898
• Goodness-of-fit parameter for all reflections included in the refinement: 0.937
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No