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Information card for entry 4088765
Preview
| Coordinates | 4088765.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C53 H70 F3 N2 O5 Os P S |
|---|---|
| Calculated formula | C53 H70 F3 N2 O5 Os P S |
| Title of publication | Dehydrogenative Addition of Aldehydes to a Mixed NHC-Osmium-Phosphine Hydroxide Complex: Formation of Carboxylate Derivatives |
| Authors of publication | Buil, María L.; Cardo, Juan J. F.; Esteruelas, Miguel A.; Oñate, Enrique |
| Journal of publication | Organometallics |
| Year of publication | 2016 |
| Journal volume | 35 |
| Journal issue | 13 |
| Pages of publication | 2171 |
| a | 11.0512 ± 0.0014 Å |
| b | 23.076 ± 0.003 Å |
| c | 20.426 ± 0.003 Å |
| α | 90° |
| β | 90.561 ± 0.002° |
| γ | 90° |
| Cell volume | 5208.7 ± 1.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0452 |
| Residual factor for significantly intense reflections | 0.0311 |
| Weighted residual factors for significantly intense reflections | 0.0708 |
| Weighted residual factors for all reflections included in the refinement | 0.0753 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.204 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237810 (current) | 2019-11-24 | cif/ Adding structures of 4088764, 4088765 via cif-deposit CGI script. |
4088765.cif |
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Users of the data should acknowledge the original authors of the
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