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Information card for entry 7011554
Preview
Coordinates | 7011554.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C45 H38 Cl2 N10 O10 Ru2 S |
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Calculated formula | C45 H36 Cl2 N10 O10 Ru2 S |
SMILES | [Ru]123([n]4c(cccc4)c4[n]1cccc4)([n]1c(cccc1)c1[n]2cccc1)Sc1[n]2[Ru]45([n]6c(cccc6)c6[n]4cccc6)([n]4c(cccc4)c4[n]5cccc4)Oc2cc([n]31)C.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].O |
Title of publication | Dinuclear bis(bipyridine)ruthenium(ii) complexes [(bpy)2RuII{L}2‒RuII(bpy)2]2+ incorporating thiouracil-based dianionic asymmetric bridging ligands: synthesis, structure, redox and spectroelectrochemical properties |
Authors of publication | Chakraborty, Soma; Laye, Rebecca H.; Munshi, Pradip; Paul, Rowena L.; Ward, Michael D.; Kumar Lahiri, Goutam |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 2002 |
Journal issue | 11 |
Pages of publication | 2348 |
a | 33.66 ± 0.005 Å |
b | 15.466 ± 0.002 Å |
c | 21.098 ± 0.003 Å |
α | 90° |
β | 124.033 ± 0.002° |
γ | 90° |
Cell volume | 9102 ± 2 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 7 |
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 | 0.0917 |
Residual factor for significantly intense reflections | 0.0428 |
Weighted residual factors for significantly intense reflections | 0.0882 |
Weighted residual factors for all reflections included in the refinement | 0.1042 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.953 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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