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Information card for entry 4088183
Preview
| Coordinates | 4088183.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H43 P2 Ru |
|---|---|
| Calculated formula | C27 H43 P2 Ru |
| SMILES | [Ru]12345([P](Cc6c2c(ccc6)C[P]1(C(C)C)C(C)C)(C(C)C)C(C)C)[CH]1=[CH]3C2[CH]4=[CH]5C1C2 |
| Title of publication | Synthesis of Pincer Hydrido Ruthenium Olefin Complexes for Catalytic Alkane Dehydrogenation |
| Authors of publication | Zhang, Yuxuan; Fang, Huaquan; Yao, Wubing; Leng, Xuebing; Huang, Zheng |
| Journal of publication | Organometallics |
| Year of publication | 2016 |
| Journal volume | 35 |
| Journal issue | 2 |
| Pages of publication | 181 |
| a | 15.0644 ± 0.001 Å |
| b | 29.8369 ± 0.0019 Å |
| c | 11.2616 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 5061.8 ± 0.6 Å3 |
| Cell temperature | 130 K |
| Ambient diffraction temperature | 130 K |
| Number of distinct elements | 4 |
| Space group number | 45 |
| Hermann-Mauguin space group symbol | I b a 2 |
| Hall space group symbol | I 2 -2c |
| Residual factor for all reflections | 0.0299 |
| Residual factor for significantly intense reflections | 0.0254 |
| Weighted residual factors for significantly intense reflections | 0.0572 |
| Weighted residual factors for all reflections included in the refinement | 0.0591 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.057 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237343 (current) | 2019-11-24 | cif/ Adding structures of 4088183 via cif-deposit CGI script. |
4088183.cif |
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Users of the data should acknowledge the original authors of the
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