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Information card for entry 1515382
Preview
| Coordinates | 1515382.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H82 N4 Si3 Th |
|---|---|
| Calculated formula | C40 H82 N4 Si3 Th |
| Title of publication | The role of 5f-orbital participation in unexpected inversion of the σ-bond metathesis reactivity trend of triamidoamine thorium(iv) and uranium(iv) alkyls |
| Authors of publication | Gardner, Benedict M.; Cleaves, Peter A.; Kefalidis, Christos E.; Fang, Jian; Maron, Laurent; Lewis, William; Blake, Alexander J.; Liddle, Stephen T. |
| Journal of publication | Chemical Science |
| Year of publication | 2014 |
| Journal volume | 5 |
| Journal issue | 6 |
| Pages of publication | 2489 |
| a | 18.7387 ± 0.0006 Å |
| b | 24.4559 ± 0.0007 Å |
| c | 24.9335 ± 0.0008 Å |
| α | 60.713 ± 0.003° |
| β | 89.936 ± 0.003° |
| γ | 69.909 ± 0.003° |
| Cell volume | 9163 ± 0.6 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0678 |
| Residual factor for significantly intense reflections | 0.0548 |
| Weighted residual factors for significantly intense reflections | 0.1324 |
| Weighted residual factors for all reflections included in the refinement | 0.1401 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.082 |
| 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 |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1515382.cif |
| 116155 | 2014-06-07 | cif/ Updating files of 1515379, 1515380, 1515381, 1515382 Original log message: Adding full bibliography for 1515379--1515382.cif. |
1515382.cif |
| 111450 | 2014-04-23 | cif/ Adding structures of 1515379, 1515380, 1515381, 1515382 via cif-deposit CGI script. |
1515382.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.