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Information card for entry 4319905
Preview
| Coordinates | 4319905.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C74 H88 Cl16 Na4 O32 Ru2 |
|---|---|
| Calculated formula | C74 Cl16 Na4 O32 Ru2 |
| SMILES | c12c(c(c(c(c1O[Ru]134([O]25)([O](C)([Na]26([OH]C)([OH]C)[OH]C)[Ru]784(Oc4c(c(c(c(c4[O]76)Cl)Cl)Cl)Cl)([O]4c6c(c(c(c(c6O8)Cl)Cl)Cl)Cl)[O]3(C)[Na]45([OH]C)([OH]C)[OH]C)[O]2c2c(c(c(c(c2O1)Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl.[Na]12345([OH2])([OH]C)[O]6c7ccccc7[O]1CC[O]2CC[O]3c1c([O]4CC[O]5CC6)cccc1.[Na]12345([OH2])([OH]C)[O]6c7ccccc7[O]1CC[O]2CC[O]3c1c([O]4CC[O]5CC6)cccc1 |
| Title of publication | Syntheses, Structures, and Physicochemical Properties of Diruthenium Compounds of Tetrachlorocatecholate with Metal-Metal Bonded Ru3+(μ-OR)2Ru3+ and Ru3.5+(μ-OR)2Ru3.5+ Cores (R = CH3 and C2H5) |
| Authors of publication | Hitoshi Miyasaka; Ho-Chol Chang; Katsunori Mochizuki; Susumu Kitagawa |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2001 |
| Journal volume | 40 |
| Pages of publication | 3544 - 3554 |
| a | 19.511 ± 0.003 Å |
| b | 18.803 ± 0.002 Å |
| c | 14.1254 ± 0.0003 Å |
| α | 90° |
| β | 111.089 ± 0.0005° |
| γ | 90° |
| Cell volume | 4835 ± 0.9 Å3 |
| Cell temperature | 173.2 K |
| Number of distinct elements | 6 |
| Space group number | 12 |
| Hermann-Mauguin space group symbol | C 1 2/m 1 |
| Hall space group symbol | -C 2y |
| Residual factor for significantly intense reflections | 0.0416 |
| Weighted residual factors for all reflections included in the refinement | 0.0656 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.954 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4319905.cif |
| 120093 | 2014-07-12 | Adding DOIs to range 4/31 structures. | 4319905.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4319905.cif |
| 16710 | 2011-03-26 | ../uploads/cif-deposit/cod/cif Adding structures of 4319905 via cif-deposit CGI script. |
4319905.cif |
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