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Information card for entry 4063408
Preview
| Coordinates | 4063408.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C29 H18 Ge Ir2 O11 Ru2 |
|---|---|
| Calculated formula | C29 H18 Ge Ir2 O11 Ru2 |
| SMILES | [Ir]12345([Ir]6([Ru]1([Ru]26([H]3)(C#[O])(C#[O])C#[O])([H]4)(C#[O])(C#[O])C#[O])([H]5)(C#[O])(C#[O])C#[O])([Ge](c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])C#[O] |
| Title of publication | Transformations of Triphenylgermyl Ligands in Iridium−Ruthenium Carbonyl Cluster Complexes |
| Authors of publication | Adams, Richard D.; Kan, Yuwei; Zhang, Qiang |
| Journal of publication | Organometallics |
| Year of publication | 2011 |
| Journal volume | 30 |
| Journal issue | 2 |
| Pages of publication | 328 - 333 |
| a | 8.5766 ± 0.0011 Å |
| b | 9.4559 ± 0.0012 Å |
| c | 22.096 ± 0.003 Å |
| α | 88.52 ± 0.002° |
| β | 89.436 ± 0.002° |
| γ | 67.579 ± 0.002° |
| Cell volume | 1656 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0711 |
| Residual factor for significantly intense reflections | 0.0633 |
| Weighted residual factors for significantly intense reflections | 0.1797 |
| Weighted residual factors for all reflections included in the refinement | 0.1887 |
| 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 |
|---|---|---|---|
| 178529 (current) | 2016-03-21 | cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/34. |
4063408.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4063408.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4063408.cif |
| 19008 | 2011-05-06 | ../uploads/cif-deposit/cod/cif Adding structures of 4063407, 4063408, 4063409, 4063410, 4063411 via cif-deposit CGI script. |
4063408.cif |
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Users of the data should acknowledge the original authors of the
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