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Information card for entry 4085723
Preview
| Coordinates | 4085723.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H17 Cl2 O5 P Ru |
|---|---|
| Calculated formula | C13 H15 Cl2 O5.005 P Ru |
| Title of publication | Ruthenium Carbonyl Complexes Bearing Secondary Phosphine Oxides and Phosphinous Acids: Synthesis, Characterization, and Application in Catalysis |
| Authors of publication | Graux, Lionel V.; Giorgi, Michel; Buono, Gérard; Clavier, Hervé |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 10 |
| Pages of publication | 1864 |
| a | 17.6254 ± 0.0007 Å |
| b | 9.4691 ± 0.0004 Å |
| c | 12.5686 ± 0.0005 Å |
| α | 90° |
| β | 96.244 ± 0.002° |
| γ | 90° |
| Cell volume | 2085.21 ± 0.15 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for all reflections | 0.094 |
| Residual factor for significantly intense reflections | 0.0522 |
| Weighted residual factors for significantly intense reflections | 0.1264 |
| Weighted residual factors for all reflections included in the refinement | 0.1408 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.993 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176429 (current) | 2016-02-13 | cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary. |
4085723.cif |
| 176428 | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
4085723.cif |
| 140188 | 2015-07-05 | cif/ Updating files of 4085723, 4085724, 4085725 Original log message: Adding full bibliography for 4085723--4085725.cif. |
4085723.cif |
| 136339 | 2015-05-13 | cif/ Adding structures of 4085723 via cif-deposit CGI script. |
4085723.cif |
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Users of the data should acknowledge the original authors of the
structural data.