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Information card for entry 1566938
Preview
| Coordinates | 1566938.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H58 Tm |
|---|---|
| Calculated formula | C34 H58 Tm |
| Title of publication | CO reductive oligomerization by a divalent thulium complex and CO2-induced functionalization |
| Authors of publication | Simler, Thomas; McCabe, Karl Nael; Maron, Laurent; Nocton, Grégory |
| Journal of publication | Chemical Science |
| Year of publication | 2022 |
| a | 19.4715 ± 0.0009 Å |
| b | 18.0905 ± 0.001 Å |
| c | 19.5394 ± 0.001 Å |
| α | 90° |
| β | 109.702 ± 0.002° |
| γ | 90° |
| Cell volume | 6479.8 ± 0.6 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0821 |
| Residual factor for significantly intense reflections | 0.0406 |
| Weighted residual factors for significantly intense reflections | 0.0722 |
| Weighted residual factors for all reflections included in the refinement | 0.0833 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.006 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 275283 (current) | 2022-05-10 | cif/ Adding structures of 1566938, 1566939, 1566940, 1566941, 1566942, 1566943, 1566944, 1566945, 1566946 via cif-deposit CGI script. |
1566938.cif |
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Users of the data should acknowledge the original authors of the
structural data.