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Information card for entry 7122840
Preview
| Coordinates | 7122840.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H62 Li N4 Na O9 Si4 |
|---|---|
| Calculated formula | C28 H61.5 Li N4 Na O9 Si4 |
| Title of publication | Diverse outcomes of CO2 fixation using alkali metal amides including formation of a heterobimetallic lithium‒sodium carbamato-anhydride via lithium‒sodium bis-hexamethyldisilazide |
| Authors of publication | Gauld, Richard M.; Kennedy, Alan R.; McLellan, Ross; Barker, Jim; Reid, Jacqueline; Mulvey, Robert E. |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 22.2504 ± 0.0011 Å |
| b | 13.1969 ± 0.0005 Å |
| c | 17.7522 ± 0.0008 Å |
| α | 90° |
| β | 112.116 ± 0.005° |
| γ | 90° |
| Cell volume | 4829.2 ± 0.4 Å3 |
| Cell temperature | 123 K |
| Ambient diffraction temperature | 123.15 K |
| Number of distinct elements | 7 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for all reflections | 0.1023 |
| Residual factor for significantly intense reflections | 0.0891 |
| Weighted residual factors for significantly intense reflections | 0.2416 |
| Weighted residual factors for all reflections included in the refinement | 0.266 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213084 (current) | 2019-01-16 | cif/ Adding structures of 7122840, 7122841, 7122842 via cif-deposit CGI script. |
7122840.cif |
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Users of the data should acknowledge the original authors of the
structural data.