Information card for entry 4314217

Structure parameters

• Formula: C36 H38 Cl6 N2 O2 Ru S2
• Calculated formula: C36 H38 Cl6 N2 O2 Ru S2
• SMILES: [Ru]123([S](c4c(C=[N]2[C@@H]2CCCC[C@H]2[N]3=Cc2ccccc2[S]1(c1ccc(C)cc1)=O)cccc4)(c1ccc(C)cc1)=O)(Cl)Cl.C(Cl)Cl.C(Cl)Cl
• Title of publication: Ruthenium Complexes with Chiral Tetradentate Imino-Sulfoxide Ligands
• Authors of publication: Chui-Ying Lai; Wing-Leung Mak; Eddie Y. Y. Chan; Yiu-Keung Sau; Qian-Feng Zhang; Samuel M. F. Lo; Ian D. Williams; Wa-Hung Leung
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 5863 - 5870
• a: 9.58 ± 0.0019 Å
• b: 10.25 ± 0.002 Å
• c: 11.57 ± 0.002 Å
• α: 68.34 ± 0.03°
• β: 71.42 ± 0.03°
• γ: 66.57 ± 0.03°
• Cell volume: 949 ± 0.4 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 7
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0762
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.0988
• Weighted residual factors for all reflections included in the refinement: 0.106
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No