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Information card for entry 7106728
Preview
| Coordinates | 7106728.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32.5 H78 N6 Na O7 Si6 U |
|---|---|
| Calculated formula | C32.5 H78 N6 Na O7 Si6 U |
| SMILES | CCCCC.[U]12(N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C(=C)O1)(C)C)(N([Si](C)(C(=C)O2)C)[Si](C)(C)C)N=N#N.C1[O]2[Na]345[O](CC[O]5CC[O]4CC[O]3CC2)C1 |
| Title of publication | Towards high-valent uranium compounds from metallacyclic uranium(IV) precursors |
| Authors of publication | Olivier Benaud; Jean-Claude Berthet; Pierre Thuery; Michel Ephritikhine |
| Journal of publication | Chem.Commun. |
| Year of publication | 2011 |
| Journal volume | 47 |
| Pages of publication | 9057 |
| a | 15.2539 ± 0.0003 Å |
| b | 18.705 ± 0.0009 Å |
| c | 39.6518 ± 0.0017 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 11313.6 ± 0.8 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0903 |
| Residual factor for significantly intense reflections | 0.0489 |
| Weighted residual factors for significantly intense reflections | 0.1088 |
| Weighted residual factors for all reflections included in the refinement | 0.1209 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176453 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7106728.cif |
| 106664 | 2014-03-15 | cif/ (saulius@koala.ibt.lt) Adding DOIs to the rest of the Chem. Comm. files. Some of these files have author names differing from PubMed in diacritics (either diacritics are omitted or we have encoding problems); or they have a year difference of 1. However, since first pages always match and author names are variants of each other, I assume that DOIs are assigned correctly. |
7106728.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7106728.cif |
| 24496 | 2011-08-25 | ../uploads/cif-deposit/cod/cif Adding structures of 7106727, 7106728, 7106729 via cif-deposit CGI script. |
7106728.cif |
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