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Information card for entry 1529517
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| Coordinates | 1529517.cif |
|---|
| Chemical name | Na (H3 O) (I (O H)3 O3) |
|---|---|
| Formula | H6 I Na O7 |
| Calculated formula | H4.23 I Na O7 |
| SMILES | [I](O)(O)(O)(O)(O)O.O.[Na+] |
| Title of publication | Pyroelectric Na (H3 O) (I (O H)3 O3. Room temperature crystal structure |
| Authors of publication | Abrahams, S.C.; Bernstein, J.L. |
| Journal of publication | Journal of Chemical Physics |
| Year of publication | 1978 |
| Journal volume | 69 |
| Pages of publication | 4234 - 4237 |
| a | 6.04272 Å |
| b | 6.04272 Å |
| c | 13.2317 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 418.419 Å3 |
| Number of distinct elements | 4 |
| Space group number | 146 |
| Hermann-Mauguin space group symbol | R 3 :H |
| Hall space group symbol | R 3 |
| 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. |
1529517.cif |
| 153949 | 2015-09-04 | cif/ Adding structures of 1529517 via cif-deposit CGI script. |
1529517.cif |
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Users of the data should acknowledge the original authors of the
structural data.