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Information card for entry 1521288
Preview
| Coordinates | 1521288.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | mu-carbido-[(2,2':6',2''-terpyridine)silver(I)-dichlorobis(tricyclohexylphosphine)ruthenium(VI)]triflate |
|---|---|
| Formula | C55 H79 Ag Cl8 F3 N3 O3 P2 Ru S |
| Calculated formula | C55 H79 Ag Cl8 F3 N3 O3 P2 Ru S |
| SMILES | [Ru](Cl)([P](C1CCCCC1)(C1CCCCC1)C1CCCCC1)([P](C1CCCCC1)(C1CCCCC1)C1CCCCC1)(Cl)#C[Ag]12[n]3c(c4[n]1c(ccc4)c1[n]2cccc1)cccc3.ClC(Cl)Cl.S(=O)(=O)(C(F)(F)F)[O-].ClC(Cl)Cl |
| Title of publication | Carbide complexes as π-acceptor ligands |
| Authors of publication | Reinholdt, Anders; Vibenholt, Johan E.; Morsing, Thorbjørn J.; Schau-Magnussen, Magnus; Reeler, Nini E. A.; Bendix, Jesper |
| Journal of publication | Chem. Sci. |
| Year of publication | 2015 |
| Journal volume | 6 |
| Journal issue | 10 |
| Pages of publication | 5815 |
| a | 14.248 ± 0.0009 Å |
| b | 15.814 ± 0.0018 Å |
| c | 16.607 ± 0.0018 Å |
| α | 70.503 ± 0.009° |
| β | 74.933 ± 0.005° |
| γ | 68.534 ± 0.009° |
| Cell volume | 3241.9 ± 0.6 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 K |
| Number of distinct elements | 10 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0921 |
| Residual factor for significantly intense reflections | 0.0605 |
| Weighted residual factors for significantly intense reflections | 0.1373 |
| Weighted residual factors for all reflections included in the refinement | 0.1571 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 170949 (current) | 2015-12-09 | cif/ Updating files of 1521279, 1521280, 1521281, 1521282, 1521283, 1521284, 1521285, 1521286, 1521287, 1521288, 1521289, 1521290 Original log message: Adding full bibliography for 1521279--1521290.cif. |
1521288.cif |
| 141002 | 2015-07-08 | cif/ Adding structures of 1521279, 1521280, 1521281, 1521282, 1521283, 1521284, 1521285, 1521286, 1521287, 1521288, 1521289, 1521290 via cif-deposit CGI script. |
1521288.cif |
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