Information card for entry 1514794

Structure parameters

• Formula: C24.5 H28.5 Cl1.5 N4 O6 Ru
• Calculated formula: C24.5 H28.5 Cl1.5 N4 O6 Ru
• SMILES: [Ru]1234([n]5ccccc5C[N]1(Cc1[n]2cccc1)Cc1[n]4cccc1)OC(=CC(=[O]3)C)C.Cl(=O)(=O)(=O)[O-].ClCCl.CCCCC
• Title of publication: Delivery and release of curcumin by a hypoxia-activated cobalt chaperone: a XANES and FLIM study
• Authors of publication: Renfrew, Anna K.; Bryce, Nicole S.; Hambley, Trevor W.
• Journal of publication: Chemical Science
• Year of publication: 2013
• Journal volume: 4
• Journal issue: 9
• Pages of publication: 3731
• a: 8.906 ± 0.0009 Å
• b: 17.7086 ± 0.0017 Å
• c: 17.021 ± 0.0017 Å
• α: 90°
• β: 91.073 ± 0.004°
• γ: 90°
• Cell volume: 2684 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.044
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.1007
• Weighted residual factors for all reflections included in the refinement: 0.104
• Goodness-of-fit parameter for all reflections included in the refinement: 1.215
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No