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Information card for entry 7123054
Preview
| Coordinates | 7123054.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C8 H18 B6 Li N4 |
|---|---|
| Calculated formula | C8 H18 B6 Li N4 |
| Title of publication | Molten metal closo-borate solvates |
| Authors of publication | Møller, Kasper T.; Paskevicius, Mark; Andreasen, Jacob Ginnerup; Lee, Junqiao; Chen-Tan, Nigel; Overgaard, Jacob; Payandeh, Seyedhosein; Silvester, Debbie S.; Buckley, Craig; Jensen, Torben Rene R. |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 10.0374 ± 0.0004 Å |
| b | 10.0374 ± 0.0004 Å |
| c | 31.778 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3201.6 ± 0.3 Å3 |
| Cell temperature | 100 ± 1 K |
| Ambient diffraction temperature | 100 ± 1 K |
| Number of distinct elements | 5 |
| Space group number | 92 |
| Hermann-Mauguin space group symbol | P 41 21 2 |
| Hall space group symbol | P 4abw 2nw |
| Residual factor for all reflections | 0.0776 |
| Residual factor for significantly intense reflections | 0.0522 |
| Weighted residual factors for significantly intense reflections | 0.1049 |
| Weighted residual factors for all reflections included in the refinement | 0.1175 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213839 (current) | 2019-02-26 | cif/ Adding structures of 7123053, 7123054 via cif-deposit CGI script. |
7123054.cif |
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Users of the data should acknowledge the original authors of the
structural data.