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Information card for entry 2106835
Preview
| Coordinates | 2106835.cif |
|---|
| Chemical name | Zr2 (S O4)4 (H2 O)14 |
|---|---|
| Formula | H28 O30 S4 Zr2 |
| Calculated formula | O30 S4 Zr2 |
| SMILES | [Zr]12([OH2])([OH2])([OH2])([OH2])(OS(=O)(=O)O1)OS(=O)(=O)O[Zr]1([OH2])([OH2])([OH2])([OH2])(OS(=O)(=O)O1)OS(=O)(=O)O2.O.O.O.O.O.O |
| Title of publication | The Crystal Chemistry of Zirconium Sulphates. I. The Structure of the Heptahydrate, a Dimer with the Formula Zr2 (S O4)4 (H2 O)7 |
| Authors of publication | Bear, I.J.; Mumme, W.G. |
| Journal of publication | Acta Crystallographica B (24,1968-38,1982) |
| Year of publication | 1969 |
| Journal volume | 25 |
| Pages of publication | 1558 - 1565 |
| a | 12.04 Å |
| b | 6.36 Å |
| c | 8.28 Å |
| α | 93° |
| β | 92.4° |
| γ | 95.9° |
| Cell volume | 629.1 Å3 |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 200438 (current) | 2017-09-11 | cif Fixing (or adding) some Z values and formulae to more sensible values |
2106835.cif |
| 176429 | 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. |
2106835.cif |
| 160775 | 2015-10-07 | cif/ Adding structures of 2106835 via cif-deposit CGI script. |
2106835.cif |
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Users of the data should acknowledge the original authors of the
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