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Information card for entry 7123754
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| Coordinates | 7123754.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | P2PCoCOSitBuPh2 |
|---|---|
| Formula | C44.53 H56.84 Co O P3 Si |
| Calculated formula | C44.5231 H56.838 Co O P3 Si |
| Title of publication | O-Functionalization of a Cobalt Carbonyl Generates a Terminal Cobalt Carbyne |
| Authors of publication | Deegan, Meaghan M.; Peters, Jonas C. |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 10.4158 ± 0.0011 Å |
| b | 16.6407 ± 0.0012 Å |
| c | 12.8005 ± 0.0011 Å |
| α | 90° |
| β | 95.289 ± 0.004° |
| γ | 90° |
| Cell volume | 2209.2 ± 0.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 99.95 K |
| Number of distinct elements | 6 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0337 |
| Residual factor for significantly intense reflections | 0.0321 |
| Weighted residual factors for significantly intense reflections | 0.0804 |
| Weighted residual factors for all reflections included in the refinement | 0.0811 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.072 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216665 (current) | 2019-07-02 | cif/ Adding structures of 7123749, 7123750, 7123751, 7123752, 7123753, 7123754, 7123755 via cif-deposit CGI script. |
7123754.cif |
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Users of the data should acknowledge the original authors of the
structural data.