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Information card for entry 7124946
Preview
| Coordinates | 7124946.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C167 H278 Al4 N8 O12 |
|---|---|
| Calculated formula | C167 H278 Al4 N8 O12 |
| Title of publication | Aluminium salalens vs. salans: "Initiator Design" for the isoselective polymerisation of rac-lactide. |
| Authors of publication | McKeown, Paul; Davidson, Matthew G.; Kociok-Köhn, Gabriele; Jones, Matthew D. |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2016 |
| Journal volume | 52 |
| Journal issue | 68 |
| Pages of publication | 10431 - 10434 |
| a | 29.9091 ± 0.0005 Å |
| b | 11.0908 ± 0.0002 Å |
| c | 25.9834 ± 0.0004 Å |
| α | 90° |
| β | 108.075 ± 0.002° |
| γ | 90° |
| Cell volume | 8193.8 ± 0.3 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | I 1 2/a 1 |
| Hall space group symbol | -I 2ya |
| Residual factor for all reflections | 0.0399 |
| Residual factor for significantly intense reflections | 0.0368 |
| Weighted residual factors for significantly intense reflections | 0.0989 |
| Weighted residual factors for all reflections included in the refinement | 0.1017 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 234374 (current) | 2019-11-23 | cif/ Adding structures of 7124946, 7124947, 7124948, 7124949 via cif-deposit CGI script. |
7124946.cif |
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Users of the data should acknowledge the original authors of the
structural data.