Information card for entry 1514795

Structure parameters

• Formula: C34 H31 Cl3 N4 O6 Ru
• Calculated formula: C34 H31 Cl3 N4 O6 Ru
• SMILES: c1cccc2C[N]34Cc5cccc[n]5[Ru]54([n]12)([n]1c(C3)cccc1)OC(=CC(c1ccccc1)=[O]5)c1ccccc1.[O-]Cl(=O)(=O)=O.ClCCl
• 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: 23.297 ± 0.002 Å
• b: 12.4626 ± 0.0012 Å
• c: 25.803 ± 0.003 Å
• α: 90°
• β: 115.977 ± 0.004°
• γ: 90°
• Cell volume: 6734.8 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0411
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.0717
• Weighted residual factors for all reflections included in the refinement: 0.0793
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No