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Information card for entry 2107181
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| Coordinates | 2107181.cif |
|---|
| Chemical name | H3 O C F3 S O3 |
|---|---|
| Formula | C H3 F3 O4 S |
| Calculated formula | C H3 F3 O4 S |
| Title of publication | Hydrogen-bond studies. LXXIII. The crystal structure of trifluoromethanesulphonic acid monohydrate, (H3 O)(+) (C F3 S O3)(-), at 298 and 83K |
| Authors of publication | Spencer, J.B.; Lundgren, J.O. |
| Journal of publication | Acta Crystallographica B (24,1968-38,1982) |
| Year of publication | 1973 |
| Journal volume | 29 |
| Pages of publication | 1923 - 1928 |
| a | 5.9634 Å |
| b | 9.975 Å |
| c | 9.708 Å |
| α | 90° |
| β | 98.661° |
| γ | 90° |
| Cell volume | 570.894 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. |
2107181.cif |
| 167886 | 2015-10-14 | cif/ Adding structures of 2107181 via cif-deposit CGI script. |
2107181.cif |
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Users of the data should acknowledge the original authors of the
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