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Information card for entry 1528620
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| Coordinates | 1528620.cif |
|---|---|
| External links | PubChem |
| Formula | H2 O |
|---|---|
| Calculated formula | H2 O |
| Title of publication | Crystal structures of the high-pressure froms of ice: Ice III |
| Authors of publication | Kamb, W.B.; Datta, S.K. |
| Journal of publication | Nature (London) |
| Year of publication | 1960 |
| Journal volume | 187 |
| Pages of publication | 140 - 141 |
| a | 6.8 Å |
| b | 6.8 Å |
| c | 6.8 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 314.432 Å3 |
| Number of distinct elements | 2 |
| Space group number | 92 |
| Hermann-Mauguin space group symbol | P 41 21 2 |
| Hall space group symbol | P 4abw 2nw |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301777 (current) | 2025-08-18 | Add cross-references to PubChem compounds in COD range 1/52 Each referenced PubChem compound corresponds to the full crystal structure. |
1528620.cif |
| 211196 | 2018-09-27 | cod/ Removing the _chemical_name_common and _chemical_name_systematic data items that contained the summary chemical formula instead of the chemical name from 6249 entries. |
1528620.cif |
| 186638 | 2016-09-18 | cif/1/ (antanas@kurmis) Adding attached hydrogens to O atoms. |
1528620.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. |
1528620.cif |
| 151103 | 2015-07-13 | cif/ Adding structures of 1528620 via cif-deposit CGI script. |
1528620.cif |
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Users of the data should acknowledge the original authors of the
structural data.