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Information card for entry 7036334
Preview
| Coordinates | 7036334.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | PP-NO2 |
|---|---|
| Chemical name | PP-NO2 |
| Formula | C47 H43 F6 N4 O4 P3 Ru |
| Calculated formula | C47 H43 F6 N4 O4 P3 Ru |
| SMILES | c1cccc2c3cccc4c5cccc[n]5[Ru]5([n]12)([n]34)(N(=O)=O)[P](c1ccccc1)(c1ccccc1)c1ccccc1[P]5(c1ccccc1)c1ccccc1.CO.CO.[P](F)(F)(F)(F)(F)[F-] |
| Title of publication | Syntheses and properties of phosphine-substituted ruthenium(ii) polypyridine complexes with nitrogen oxides. |
| Authors of publication | Nakamura, Go; Kondo, Mio; Crisalli, Meredith; Lee, Sze Koon; Shibata, Akane; Ford, Peter C.; Masaoka, Shigeyuki |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2015 |
| Journal volume | 44 |
| Journal issue | 39 |
| Pages of publication | 17189 - 17200 |
| a | 17.1049 ± 0.0006 Å |
| b | 13.0763 ± 0.0006 Å |
| c | 20.1547 ± 0.0008 Å |
| α | 90° |
| β | 106.853 ± 0.003° |
| γ | 90° |
| Cell volume | 4314.4 ± 0.3 Å3 |
| Cell temperature | 103 ± 2 K |
| Ambient diffraction temperature | 103 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0719 |
| Residual factor for significantly intense reflections | 0.0397 |
| Weighted residual factors for significantly intense reflections | 0.0831 |
| Weighted residual factors for all reflections included in the refinement | 0.0941 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176428 (current) | 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. |
7036334.cif |
| 161246 | 2015-10-09 | cif/ Updating files of 7036332, 7036333, 7036334 Original log message: Adding full bibliography for 7036332--7036334.cif. |
7036334.cif |
| 153782 | 2015-08-29 | cif/ Adding structures of 7036332, 7036333, 7036334 via cif-deposit CGI script. |
7036334.cif |
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