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Information card for entry 1518553
Preview
| Coordinates | 1518553.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H16 F6 Li N O8 S2 |
|---|---|
| Calculated formula | C10 H16 F6 Li N O8 S2 |
| SMILES | S(O[Li]123[O]4CC[O]1CC[O]2CC[O]3CC4)(=O)(=NS(=O)(=O)C(F)(F)F)C(F)(F)F |
| Title of publication | Effect of ionic size on solvate stability of glyme-based solvate ionic liquids. |
| Authors of publication | Mandai, Toshihiko; Yoshida, Kazuki; Tsuzuki, Seiji; Nozawa, Risa; Masu, Hyuma; Ueno, Kazuhide; Dokko, Kaoru; Watanabe, Masayoshi |
| Journal of publication | The journal of physical chemistry. B |
| Year of publication | 2015 |
| Journal volume | 119 |
| Journal issue | 4 |
| Pages of publication | 1523 - 1534 |
| a | 8.838 ± 0.003 Å |
| b | 9.535 ± 0.003 Å |
| c | 11.379 ± 0.004 Å |
| α | 81.162 ± 0.009° |
| β | 78.012 ± 0.009° |
| γ | 79.457 ± 0.009° |
| Cell volume | 915.5 ± 0.5 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.0424 |
| Weighted residual factors for all reflections included in the refinement | 0.1248 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71075 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. |
1518553.cif |
| 130756 | 2015-02-04 | cif/ Updating files of 1518551, 1518552, 1518553, 1518554, 1518555, 1518556 Original log message: Adding full bibliography for 1518551--1518556.cif. |
1518553.cif |
| 129922 | 2015-01-17 | cif/ Adding structures of 1518551, 1518552, 1518553, 1518554, 1518555, 1518556 via cif-deposit CGI script. |
1518553.cif |
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Users of the data should acknowledge the original authors of the
structural data.