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Information card for entry 4063867
Preview
| Coordinates | 4063867.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C63 H56.5 F3 Ir N3.5 O7 Os P4 S |
|---|---|
| Calculated formula | C63 H56.5 F3 Ir N3.5 O7 Os P4 S |
| Title of publication | Alkyne/Methylene Coupling at Adjacent Iridium/Osmium Centers: Facile Carbon−Carbon and Carbon−Oxygen Bond Formation |
| Authors of publication | MacDougall, Tiffany J.; Llamazares, Angela; Kuhnert, Oliver; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin |
| Journal of publication | Organometallics |
| Year of publication | 2011 |
| Journal volume | 30 |
| Journal issue | 5 |
| Pages of publication | 952 |
| a | 11.2757 ± 0.0004 Å |
| b | 13.0139 ± 0.0004 Å |
| c | 21.2552 ± 0.0007 Å |
| α | 91.0983 ± 0.0003° |
| β | 99.1756 ± 0.0003° |
| γ | 91.41 ± 0.0003° |
| Cell volume | 3077.32 ± 0.18 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 9 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0188 |
| Residual factor for significantly intense reflections | 0.0176 |
| Weighted residual factors for significantly intense reflections | 0.0448 |
| Weighted residual factors for all reflections included in the refinement | 0.0452 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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Users of the data should acknowledge the original authors of the
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