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Information card for entry 7712096
Preview
| Coordinates | 7712096.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C58 H77 Li4 Ni2 O4 |
|---|---|
| Calculated formula | C58 H77 Li4 Ni2 O4 |
| Title of publication | Diphenylacetylene stabilised alkali-metal nickelates: synthesis, structure and catalytic applications. |
| Authors of publication | Borys, Andryj M.; Hevia, Eva |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2023 |
| Journal volume | 52 |
| Journal issue | 7 |
| Pages of publication | 2098 - 2105 |
| a | 12.37091 ± 0.00007 Å |
| b | 19.444 ± 0.0001 Å |
| c | 23.57916 ± 0.00013 Å |
| α | 90° |
| β | 101.868 ± 0.0005° |
| γ | 90° |
| Cell volume | 5550.49 ± 0.05 Å3 |
| Cell temperature | 173 ± 0.1 K |
| Ambient diffraction temperature | 173 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0441 |
| Residual factor for significantly intense reflections | 0.0411 |
| Weighted residual factors for significantly intense reflections | 0.1172 |
| Weighted residual factors for all reflections included in the refinement | 0.1201 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
| 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 |
|---|---|---|---|
| 283323 (current) | 2023-05-05 | cif/ Updating files of 7712094, 7712095, 7712096, 7712097, 7712098, 7712099, 7712100 Original log message: Adding full bibliography for 7712094--7712100.cif. |
7712096.cif |
| 280293 | 2023-01-12 | cif/ Adding structures of 7712094, 7712095, 7712096, 7712097, 7712098, 7712099, 7712100 via cif-deposit CGI script. |
7712096.cif |
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Users of the data should acknowledge the original authors of the
structural data.