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Information card for entry 1518896
Preview
| Coordinates | 1518896.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C55 H59 Cl O P2 Ru Si |
|---|---|
| Calculated formula | C55 H59 Cl O P2 Ru Si |
| SMILES | [Ru]12(Cl)([P](c3c4[O]2c2c([Si]1(C)C)cc(cc2C(C)(C)c4cc(c3)C(C)(C)C)C(C)(C)C)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1 |
| Title of publication | Synthesis of Ruthenium Complexes with a NonspectatorSi,O,P-Chelate Ligand: Interconversion between a Hydrido(η2-silane) Complex and a Silyl Complex Leading to Catalytic Alkene Hydrogenation |
| Authors of publication | Komuro, Takashi; Arai, Takafumi; Kikuchi, Kei; Tobita, Hiromi |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 7 |
| Pages of publication | 1211 |
| a | 11.0035 ± 0.0001 Å |
| b | 11.187 ± 0.0002 Å |
| c | 22.7319 ± 0.0005 Å |
| α | 91.9741 ± 0.0005° |
| β | 93.1478 ± 0.0008° |
| γ | 118.088 ± 0.0018° |
| Cell volume | 2459.15 ± 0.08 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1071 |
| Residual factor for significantly intense reflections | 0.0753 |
| Weighted residual factors for significantly intense reflections | 0.1536 |
| Weighted residual factors for all reflections included in the refinement | 0.1692 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.173 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1518896.cif |
| 138297 | 2015-06-05 | cif/ Updating files of 1518895, 1518896 Original log message: Adding full bibliography for 1518895--1518896.cif. |
1518896.cif |
| 134390 | 2015-03-26 | cif/ Adding structures of 1518895, 1518896 via cif-deposit CGI script. |
1518896.cif |
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Users of the data should acknowledge the original authors of the
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