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Information card for entry 2104021
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| Coordinates | 2104021.cif |
|---|---|
| Original IUCr paper | HTML |
| Common name | Lithium bis(oxalato)borate |
|---|---|
| Chemical name | Lithium bis(oxalato)borate |
| Formula | C4 B Li O8 |
| Calculated formula | C4 B Li O8 |
| SMILES | O1C(=O)C(=O)O[B]21OC(=O)C(=O)O2.[Li+] |
| Title of publication | Structures of potassium, sodium and lithium bis(oxalato)borate salts from powder diffraction data |
| Authors of publication | Zavalij, Peter Y.; Yang, Shoufeng; Whittingham, M. Stanley |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2003 |
| Journal volume | 59 |
| Journal issue | 6 |
| Pages of publication | 753 - 759 |
| a | 6.3635 ± 0.0004 Å |
| b | 7.5998 ± 0.0003 Å |
| c | 13.1715 ± 0.0009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 636.99 ± 0.06 Å3 |
| Cell temperature | 295 K |
| Ambient diffraction temperature | 295 K |
| Number of distinct elements | 4 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Goodness-of-fit parameter for all reflections | 2.35 |
| Diffraction radiation wavelength | 1.54056 Å |
| Diffraction radiation type | CuKα~1~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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Users of the data should acknowledge the original authors of the
structural data.