Information card for entry 7002387

Structure parameters

• Formula: C100 H106 F12 N8 O17 Ru4 S4
• Calculated formula: C100 H106 F12 N8 O17 Ru4 S4
• SMILES: FC(S(=O)(=O)[O-])(F)F.FC(F)(F)S(=O)(=O)[O-].[n]12ccc(cc1)/C=C/c1cc[n](cc1)[Ru]134567([N](=C8C(=[N](c9ccccc9)[Ru]9%10%11%12%13([n]%14ccc(cc%14)/C=C/c%14cc[n](cc%14)[Ru]%14%15%16%17%18%19([N](=C%20C(=[N]([Ru]%21%22%23%24%252([c]2([cH]%21[cH]%22[c]%23([cH]%24[cH]%252)C)C(C)C)O%20)c2ccccc2)O%14)c2ccccc2)[c]2([cH]%15[cH]%16[c]%17([cH]%18[cH]%192)C)C(C)C)(O8)[c]2([cH]9[cH]%10[c]%11([cH]%12[cH]%132)C)C(C)C)O1)c1ccccc1)[c]1([cH]3[cH]4[c]5([cH]6[cH]71)C)C(C)C.O(CC)CC.FC(F)(F)S(=O)(=O)[O-].FC(F)(F)S(=O)(=O)[O-]
• Title of publication: Synthesis and characterization of molecular rectangles of half-sandwich p-cymene ruthenium complexes bearing oxamidato ligands
• Authors of publication: Zhang, Wan-Zheng; Han, Ying-Feng; Lin, Yue-Jian; Jin, Guo-Xin
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 39
• Pages of publication: 8426 - 8431
• a: 16.56 ± 0.005 Å
• b: 41.448 ± 0.013 Å
• c: 15.582 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10695 ± 6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.154
• Residual factor for significantly intense reflections: 0.0747
• Weighted residual factors for significantly intense reflections: 0.1841
• Weighted residual factors for all reflections included in the refinement: 0.2097
• Goodness-of-fit parameter for all reflections included in the refinement: 0.955
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No