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Information card for entry 7226198
Preview
| Coordinates | 7226198.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C54 H65 Cl2 N2 P Ru S |
|---|---|
| Calculated formula | C54 H65 Cl2 N2 P 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 | 29.2136 ± 0.0007 Å |
| b | 14.4024 ± 0.0003 Å |
| c | 24.4525 ± 0.001 Å |
| α | 90° |
| β | 97.527 ± 0.003° |
| γ | 90° |
| Cell volume | 10199.6 ± 0.5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 7 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0959 |
| Residual factor for significantly intense reflections | 0.0662 |
| Weighted residual factors for significantly intense reflections | 0.1657 |
| Weighted residual factors for all reflections included in the refinement | 0.1802 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| 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. |
7226198.cif |
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Users of the data should acknowledge the original authors of the
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