Information card for entry 7107071

Structure parameters

• Formula: C22 H22 Cl2 N5 Na O10 Os S
• Calculated formula: C22 H22 Cl2 N5 Na O10 Os S
• SMILES: [Na+].O=Cl(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].[Os]123(S(=O)(CC[NH2]1)=O)([n]1ccccc1c1cccc[n]21)[n]1c(c2cccc[n]32)cccc1
• Title of publication: A bis-bipyridine osmium(II) complex with an N,S-chelating 2-aminoethanesulfinate: photoinduced conversion of amine to imine donor group by air oxidation
• Authors of publication: Motoshi Tamura; Kiyoshi Tsuge; Asako Igashira-Kamiyama; Takumi Konno
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 12464
• a: 9.5421 ± 0.0003 Å
• b: 16.8001 ± 0.0007 Å
• c: 34.0526 ± 0.001 Å
• α: 90°
• β: 96.613 ± 0.001°
• γ: 90°
• Cell volume: 5422.6 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 8
• 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: 0.0568
• Residual factor for significantly intense reflections: 0.0462
• Weighted residual factors for significantly intense reflections: 0.1179
• Weighted residual factors for all reflections included in the refinement: 0.1253
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No