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Information card for entry 1527638
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| Coordinates | 1527638.cif |
|---|
| Chemical name | K4 (Fe (C N)6) (H2 O)3 |
|---|---|
| Formula | C6 H6 Fe K4 N6 O3 |
| Calculated formula | C6 H6 Fe K4 N6 O3 |
| SMILES | O.C(#N)[Fe](C#N)(C#N)(C#N)(C#N)C#N.[K+].[K+].O.[K+].[K+].O |
| Title of publication | Nuclear magnetic resonance and X-Ray studies of potassium ferrocyanide trihydrate crystal |
| Authors of publication | Kiriyama, R.; Niizeki, N.; Kiriyama, H.; Wada, T.; Hirabayashi, H. |
| Journal of publication | Journal of the Physical Society of Japan |
| Year of publication | 1964 |
| Journal volume | 19 |
| Pages of publication | 540 - 549 |
| a | 9.396 Å |
| b | 16.85999 Å |
| c | 9.413 Å |
| α | 90° |
| β | 90.05° |
| γ | 90° |
| Cell volume | 1491.17 Å3 |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 186638 (current) | 2016-09-18 | cif/1/ (antanas@kurmis) Adding attached hydrogens to O atoms. |
1527638.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. |
1527638.cif |
| 149311 | 2015-07-13 | cif/ Adding structures of 1527638 via cif-deposit CGI script. |
1527638.cif |
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Users of the data should acknowledge the original authors of the
structural data.