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Information card for entry 4325161
Preview
| Coordinates | 4325161.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C108 H139.52 F12 N20 Na O25.76 P2 Ru4 S4 |
|---|---|
| Calculated formula | C108 H104 F12 N20 Na O25.75 P2 Ru4 S4 |
| SMILES | [Na]1([O]=C2O[Ru]34(S(=O)(=O)C([C@H]2[NH3+])(C)C)([n]2ccccc2c2cccc[n]42)[n]2ccccc2c2cccc[n]32)([O]=C2O[Ru]34(S(=O)(=O)C([C@H]2[NH3+])(C)C)([n]2ccccc2c2cccc[n]42)[n]2ccccc2c2cccc[n]32)([O]=C2O[Ru]34(S(=O)(=O)C([C@H]2[NH3+])(C)C)([n]2ccccc2c2cccc[n]42)[n]2ccccc2c2cccc[n]32)([O]=C2O[Ru]34(S(=O)(=O)C([C@H]2[NH3+])(C)C)([n]2ccccc2c2cccc[n]42)[n]2ccccc2c2cccc[n]32)([F][P]([F]1)(F)(F)(F)F)[OH2].[F-][P](F)(F)(F)(F)F.CCO.CCO.CCO.CCO.O.O.O.O.O |
| Title of publication | Bis(bipyridine)ruthenium(II) Complexes with an Aliphatic Sulfinato Donor: Synthesis, Characterization, and Properties |
| Authors of publication | Motoshi Tamura; Kiyoshi Tsuge; Asako Igashira-Kamiyama; Takumi Konno |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2011 |
| Journal volume | 50 |
| Pages of publication | 4764 - 4771 |
| a | 17.0154 ± 0.0018 Å |
| b | 17.0154 ± 0.0018 Å |
| c | 45.5 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 13173 ± 2 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 9 |
| Space group number | 97 |
| Hermann-Mauguin space group symbol | I 4 2 2 |
| Hall space group symbol | I 4 2 |
| Residual factor for all reflections | 0.0575 |
| Residual factor for significantly intense reflections | 0.0562 |
| Weighted residual factors for significantly intense reflections | 0.1952 |
| Weighted residual factors for all reflections included in the refinement | 0.1962 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.759 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 289268 (current) | 2024-02-02 | Fixing some Z values and formulae |
4325161.cif |
| 176467 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4325161.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4325161.cif |
| 43614 | 2012-03-15 | ../uploads/cif-deposit/cod/cif Adding structures of 4325161 via cif-deposit CGI script. |
4325161.cif |
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