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Information card for entry 2106749
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| Coordinates | 2106749.cif |
|---|
| Chemical name | Na S C N |
|---|---|
| Formula | C N Na S |
| Calculated formula | C N Na S |
| SMILES | C(#N)[S-].[Na+] |
| Title of publication | The experimental charge distribution in sulfur-containing molecules. Structure determination and electron density study of Na S C N at reduced temperatures |
| Authors of publication | Bats, J.W.; Coppens, P.; Kvick, A. |
| Journal of publication | Acta Crystallographica B (24,1968-38,1982) |
| Year of publication | 1977 |
| Journal volume | 33 |
| Pages of publication | 1534 - 1542 |
| a | 4.035 Å |
| b | 5.601 Å |
| c | 13.276 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 300.038 Å3 |
| Number of distinct elements | 4 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P m c n |
| Hall space group symbol | -P 2n 2a |
| 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. |
2106749.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. |
2106749.cif |
| 156448 | 2015-09-17 | cif/ Adding structures of 2106749 via cif-deposit CGI script. |
2106749.cif |
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Users of the data should acknowledge the original authors of the
structural data.