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Information card for entry 1541716
Preview
| Coordinates | 1541716.cif |
|---|
| Chemical name | Na3 P O3 C O2 (H2 O)6 |
|---|---|
| Formula | C H12 Na3 O11 P |
| Calculated formula | C H12 Na3 O11 P |
| SMILES | C([O-])(=O)P(=[O])([O-])[O-].[Na+].O.[Na+].O.[Na+].O.O.O.O |
| Title of publication | Crystal Structure of Trisodium Phosphonoformate Hexahydrate, Na3 P O3 C O2 (H2 O)6 |
| Authors of publication | Naqvi, R.R.; Wheatley, P.J. |
| Journal of publication | Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971) |
| Year of publication | 1971 |
| Journal volume | 1971 |
| Pages of publication | 2751 - 2754 |
| a | 9.087 Å |
| b | 12.161 Å |
| c | 10.217 Å |
| α | 90° |
| β | 103.95° |
| γ | 90° |
| Cell volume | 1095.75 Å3 |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| 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. |
1541716.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. |
1541716.cif |
| 173162 | 2016-01-03 | cif/ Adding structures of 1541716 via cif-deposit CGI script. |
1541716.cif |
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Users of the data should acknowledge the original authors of the
structural data.