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Information card for entry 7226200
Preview
| Coordinates | 7226200.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H32 Cl2 N2 O Ru S |
|---|---|
| Calculated formula | C27 H32 Cl2 N2 O Ru S |
| Title of publication | Synthesis and catalytic activity of ruthenium indenylidene complexes bearing unsymmetrical NHC containing a heteroaromatic moiety |
| Authors of publication | Smoleń, Michał; Kosnik, Wioletta; Loska, Rafał; Gajda, Roman; Malinska, Maura; Wozniak, Krzysztof; Grela, Karol |
| Journal of publication | RSC Adv. |
| Year of publication | 2016 |
| a | 10.5766 ± 0.0002 Å |
| b | 15.0612 ± 0.0003 Å |
| c | 34.1951 ± 0.0006 Å |
| α | 85.6667 ± 0.0014° |
| β | 88.7614 ± 0.0016° |
| γ | 89.677 ± 0.0017° |
| Cell volume | 5430.27 ± 0.18 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 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 | 0.0935 |
| Residual factor for significantly intense reflections | 0.0581 |
| Weighted residual factors for significantly intense reflections | 0.1186 |
| Weighted residual factors for all reflections included in the refinement | 0.1325 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.083 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 185706 (current) | 2016-08-09 | cif/ Adding structures of 7226196, 7226197, 7226198, 7226199, 7226200 via cif-deposit CGI script. |
7226200.cif |
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Users of the data should acknowledge the original authors of the
structural data.