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Information card for entry 1568370
Preview
| Coordinates | 1568370.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H20 F6 N2 O4 S2 |
|---|---|
| Calculated formula | C12 H20 F6 N2 O4 S2 |
| SMILES | N1=S([O-])(=O)C(C(C(S1(=O)=O)(F)F)(F)F)(F)F.[N+]1(CCCC1)(C)CCCC |
| Title of publication | Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. |
| Authors of publication | Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik |
| Journal of publication | Chemical science |
| Year of publication | 2023 |
| Journal volume | 14 |
| Journal issue | 8 |
| Pages of publication | 2200 - 2214 |
| a | 8.981 ± 0.0001 Å |
| b | 9.3656 ± 0.0001 Å |
| c | 11.9008 ± 0.0002 Å |
| α | 70.207 ± 0.001° |
| β | 75.403 ± 0.001° |
| γ | 71.869 ± 0.001° |
| Cell volume | 882.98 ± 0.02 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 0.1 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 | 0.0712 |
| Residual factor for significantly intense reflections | 0.0698 |
| Weighted residual factors for significantly intense reflections | 0.1911 |
| Weighted residual factors for all reflections included in the refinement | 0.1931 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 283153 (current) | 2023-05-05 | cif/ Updating files of 1568359, 1568360, 1568361, 1568362, 1568363, 1568364, 1568365, 1568366, 1568367, 1568368, 1568369, 1568370, 1568371 Original log message: Adding full bibliography for 1568359--1568371.cif. |
1568370.cif |
| 280680 | 2023-01-31 | cif/ Adding structures of 1568359, 1568360, 1568361, 1568362, 1568363, 1568364, 1568365, 1568366, 1568367, 1568368, 1568369, 1568370, 1568371 via cif-deposit CGI script. |
1568370.cif |
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Users of the data should acknowledge the original authors of the
structural data.