Information card for entry 4335891

Structure parameters

• Formula: C30 H32 Cl2 N8 O11 Ru
• Calculated formula: C30 H32 Cl2 N8 O11 Ru
• SMILES: [Ru]123([n]4ccccc4c4cccc[n]14)([n]1ccccc1c1cccc[n]21)[n]1c(C)c(C)[nH]c1C(=[N]3C(=O)C)NC(=O)C.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].O
• Title of publication: Visible-Light-Induced Photooxidation of Ruthenium(II) Complex with 2,2'-Biimidazole-like Ligand by Singlet Oxygen
• Authors of publication: Zheng-Zheng Li; Yan-Li Niu; Hai-Yun Zhou; Hsiu-Yi Chao; Bao-Hui Ye
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 10087 - 10095
• a: 8.483 ± 0.004 Å
• b: 19.513 ± 0.01 Å
• c: 21.032 ± 0.01 Å
• α: 90°
• β: 94.393 ± 0.008°
• γ: 90°
• Cell volume: 3471 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1164
• Residual factor for significantly intense reflections: 0.0903
• Weighted residual factors for significantly intense reflections: 0.2658
• Weighted residual factors for all reflections included in the refinement: 0.3099
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No