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Information card for entry 1517856
Preview
| Coordinates | 1517856.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C58 H77 N O5 Te U |
|---|---|
| Calculated formula | C58 H77 N O5 Te U |
| SMILES | [U]123([TeH])(Oc4c(C[N]3(Cc3c(O1)c(cc(c3)C)C13CC5CC(CC(C1)C5)C3)Cc1c(O2)c(cc(c1)C)C12CC3CC(CC(C1)C3)C2)cc(cc4C12CC3CC(CC(C1)C3)C2)C)[O](C)CCOC |
| Title of publication | Reactivity of uranium(iii) with H2E (E = S, Se, Te): synthesis of a series of mononuclear and dinuclear uranium(iv) hydrochalcogenido complexes |
| Authors of publication | Franke, Sebastian M.; Rosenzweig, Michael W.; Heinemann, Frank W.; Meyer, Karsten |
| Journal of publication | Chem. Sci. |
| Year of publication | 2015 |
| Journal volume | 6 |
| Journal issue | 1 |
| Pages of publication | 275 |
| a | 11.2439 ± 0.0015 Å |
| b | 12.9994 ± 0.0017 Å |
| c | 18.636 ± 0.003 Å |
| α | 102.273 ± 0.004° |
| β | 101.519 ± 0.004° |
| γ | 100.806 ± 0.004° |
| Cell volume | 2531.7 ± 0.6 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0215 |
| Residual factor for significantly intense reflections | 0.0205 |
| Weighted residual factors for significantly intense reflections | 0.0514 |
| Weighted residual factors for all reflections included in the refinement | 0.0518 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
1517856.cif |
| 130964 | 2015-02-04 | cif/ Updating files of 1517854, 1517855, 1517856, 1517857, 1517858, 1517859 Original log message: Adding full bibliography for 1517854--1517859.cif. |
1517856.cif |
| 124386 | 2014-09-30 | cif/ Adding structures of 1517854, 1517855, 1517856, 1517857, 1517858, 1517859 via cif-deposit CGI script. |
1517856.cif |
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Users of the data should acknowledge the original authors of the
structural data.