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Information card for entry 1518671
Preview
| Coordinates | 1518671.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | [Et3PPEt3][OTf]2 |
|---|---|
| Formula | C14 H30 F6 O6 P2 S2 |
| Calculated formula | C14 H30 F6 O6 P2 S2 |
| SMILES | S(=O)(=O)([O-])C(F)(F)F.[P+]([P+](CC)(CC)CC)(CC)(CC)CC.S(=O)(=O)([O-])C(F)(F)F |
| Title of publication | Synthesis and reactivity of cyclo-tetra(stibinophosphonium) tetracations: redox and coordination chemistry of phosphine‒antimony complexes |
| Authors of publication | Chitnis, Saurabh S.; Robertson, Alasdair P. M.; Burford, Neil; Weigand, Jan J.; Fischer, Roland |
| Journal of publication | Chem. Sci. |
| Year of publication | 2015 |
| Journal volume | 6 |
| Journal issue | 4 |
| Pages of publication | 2559 |
| a | 13.4271 ± 0.0009 Å |
| b | 11.8532 ± 0.0008 Å |
| c | 15.7504 ± 0.0011 Å |
| α | 90° |
| β | 110.993 ± 0.001° |
| γ | 90° |
| Cell volume | 2340.4 ± 0.3 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173.15 K |
| Number of distinct elements | 6 |
| 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 | 0.0538 |
| Residual factor for significantly intense reflections | 0.0372 |
| Weighted residual factors for significantly intense reflections | 0.0875 |
| Weighted residual factors for all reflections included in the refinement | 0.0961 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| 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. |
1518671.cif |
| 134906 | 2015-04-06 | cif/ Updating files of 1518666, 1518667, 1518668, 1518669, 1518670, 1518671 Original log message: Adding full bibliography for 1518666--1518671.cif. |
1518671.cif |
| 130897 | 2015-02-04 | cif/ Adding structures of 1518666, 1518667, 1518668, 1518669, 1518670, 1518671 via cif-deposit CGI script. |
1518671.cif |
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