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Information card for entry 1547997
Preview
| Coordinates | 1547997.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C89 H124 Ce K N4 O8 P4 Si4 |
|---|---|
| Calculated formula | C89 H124 Ce K N4 O8 P4 Si4 |
| Title of publication | The inverse-trans-influence in tetravalent lanthanide and actinide bis(carbene) complexes |
| Authors of publication | Matthew Gregson; Erli Lu; David P. Mills; Floriana Tuna; Eric J. L. McInnes; Christoph Hennig; Andreas C. Scheinost; Jonathan McMaster; William Lewis; Alexander J. Blake; Andrew Kerridge; Stephen T. Liddle |
| Journal of publication | Nature Communications |
| Year of publication | 2017 |
| Journal volume | 8 |
| Pages of publication | 14137 |
| a | 16.9671 ± 0.0006 Å |
| b | 17.9463 ± 0.0005 Å |
| c | 19.155 ± 0.0006 Å |
| α | 71.281 ± 0.003° |
| β | 64.086 ± 0.003° |
| γ | 65.421 ± 0.003° |
| Cell volume | 4701.3 ± 0.3 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0432 |
| Residual factor for significantly intense reflections | 0.0415 |
| Weighted residual factors for significantly intense reflections | 0.1083 |
| Weighted residual factors for all reflections included in the refinement | 0.1109 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
| 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 |
|---|---|---|---|
| 203111 (current) | 2017-11-13 | cif/ Adding structures of 1547997 via cif-deposit CGI script. |
1547997.cif |
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