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Information card for entry 2106608
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| Coordinates | 2106608.cif |
|---|
| Chemical name | Na4 (C O (P O3)2) (H2 O)2 |
|---|---|
| Formula | C H4 Na4 O9 P2 |
| Calculated formula | C H4 Na4 O9 P2 |
| SMILES | C(=O)(P(=O)([O-])[O-])P([O-])([O-])=O.[Na+].O.[Na+].O.[Na+].[Na+] |
| Title of publication | The crystal and molecular structure of carbonyldiphosphonate tetrasodium dihydrate |
| Authors of publication | Uchtman, V.A.; Jandacek, R.J. |
| Journal of publication | Acta Crystallographica B (24,1968-38,1982) |
| Year of publication | 1976 |
| Journal volume | 32 |
| Pages of publication | 488 - 492 |
| a | 8.489 Å |
| b | 8.489 Å |
| c | 6.468 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 466.104 Å3 |
| Number of distinct elements | 5 |
| Space group number | 81 |
| Hermann-Mauguin space group symbol | P -4 |
| Hall space group symbol | P -4 |
| 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. |
2106608.cif |
| 151804 | 2015-07-14 | cif/ Adding structures of 2106608 via cif-deposit CGI script. |
2106608.cif |
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Users of the data should acknowledge the original authors of the
structural data.