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Information card for entry 2106671
Preview
| Coordinates | 2106671.cif |
|---|
| Chemical name | H C F3 S O3 (H2 O)2 |
|---|---|
| Formula | C H5 F3 O5 S |
| Calculated formula | C H5 F3 O5 S |
| Title of publication | Hydrogen bond studies. XCVII. The crystal structure of trifluoromethanesulphonic acid dihydrate, H5 O2 C F3 S O3 at 225 and 85K |
| Authors of publication | Delaplane, R.G.; Olovsson, I.; Lundgren, J.O. |
| Journal of publication | Acta Crystallographica B (24,1968-38,1982) |
| Year of publication | 1975 |
| Journal volume | 31 |
| Pages of publication | 2202 - 2207 |
| a | 10.1192 Å |
| b | 8.87 Å |
| c | 7.7545 Å |
| α | 90° |
| β | 97.556° |
| γ | 90° |
| Cell volume | 689.979 Å3 |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176429 (current) | 2016-02-13 | cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary. |
2106671.cif |
| 154430 | 2015-09-05 | cif/ Adding structures of 2106671 via cif-deposit CGI script. |
2106671.cif |
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Users of the data should acknowledge the original authors of the
structural data.