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Information card for entry 2310459
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| Coordinates | 2310459.cif |
|---|---|
| External links | PubChem |
| Chemical name | Na H C N4 H2 O |
|---|---|
| Formula | C H3 N4 Na O |
| Calculated formula | C H3 N4 Na O |
| SMILES | c1[n-]nnn1.[Na+].O |
| Title of publication | The crystal and molecular structure of sodium tetrazolate monohydrate |
| Authors of publication | Palenik, G.J. |
| Journal of publication | Acta Crystallographica (1,1948-23,1967) |
| Year of publication | 1963 |
| Journal volume | 16 |
| Pages of publication | 596 - 600 |
| a | 5.868 Å |
| b | 5.624 Å |
| c | 6.45 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 212.861 Å3 |
| Number of distinct elements | 5 |
| Space group number | 51 |
| Hermann-Mauguin space group symbol | P m c m |
| Hall space group symbol | -P 2c 2 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301809 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 2/31/ Each referenced PubChem compound corresponds to the full crystal structure. |
2310459.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. |
2310459.cif |
| 176428 | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
2310459.cif |
| 149706 | 2015-07-13 | cif/ Adding structures of 2310459 via cif-deposit CGI script. |
2310459.cif |
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Users of the data should acknowledge the original authors of the
structural data.