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Information card for entry 1557547
Preview
| Coordinates | 1557547.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C117 H144 Mg4 N12 O4 |
|---|---|
| Calculated formula | C117 H144 Mg4 N12 O4 |
| Title of publication | Sterically controlled reductive oligomerisations of CO by activated magnesium(i) compounds: deltate vs. ethenediolate formation |
| Authors of publication | Yuvaraj, K.; Douair, Iskander; Jones, Dafydd D. L.; Maron, Laurent; Jones, Cameron |
| Journal of publication | Chemical Science |
| Year of publication | 2020 |
| Journal volume | 11 |
| Journal issue | 13 |
| Pages of publication | 3516 - 3522 |
| a | 15.1058 ± 0.0002 Å |
| b | 19.0783 ± 0.0002 Å |
| c | 20.0582 ± 0.0002 Å |
| α | 85.762 ± 0.001° |
| β | 88.909 ± 0.001° |
| γ | 66.998 ± 0.001° |
| Cell volume | 5306.17 ± 0.11 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0672 |
| Residual factor for significantly intense reflections | 0.0593 |
| Weighted residual factors for significantly intense reflections | 0.1696 |
| Weighted residual factors for all reflections included in the refinement | 0.1771 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 257347 (current) | 2020-10-06 | cif/ Updating files of 1557543, 1557544, 1557545, 1557546, 1557547, 1557548, 1557549, 1557550, 1557551, 1557552 Original log message: Adding full bibliography for 1557543--1557552.cif. |
1557547.cif |
| 250236 | 2020-04-05 | cif/ Updating files of 1557543, 1557544, 1557545, 1557546, 1557547, 1557548, 1557549, 1557550, 1557551, 1557552 Original log message: Adding full bibliography for 1557543--1557552.cif. |
1557547.cif |
| 249162 | 2020-03-07 | cif/ Adding structures of 1557543, 1557544, 1557545, 1557546, 1557547, 1557548, 1557549, 1557550, 1557551, 1557552 via cif-deposit CGI script. |
1557547.cif |
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Users of the data should acknowledge the original authors of the
structural data.