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Information card for entry 1536448
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| Coordinates | 1536448.cif |
|---|
| Chemical name | Na3 (Fe (N H3) (C N)5) (H2 O)7 |
|---|---|
| Formula | C5 H17 Fe N6 Na3 O7 |
| Calculated formula | C5 H17 Fe N6 Na3 O7 |
| SMILES | C(#N)[Fe](C#[N])(C#N)(C#N)(C#N)[NH3].O.O.[Na+].O.[Na+].O.[Na+].O.O.O |
| Title of publication | The crystal and molecular structure of sodium pentacyanoammineferrate(II) heptahydrate. Role of intermolecular hydrogen-bond interactions |
| Authors of publication | Parise, A.R; Castellano, E.E.; Piro, O.E.; Olabe, J.A. |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2001 |
| Journal volume | 319 |
| Pages of publication | 199 - 202 |
| a | 8.2719 Å |
| b | 9.603 Å |
| c | 11.3531 Å |
| α | 92.01° |
| β | 102.646° |
| γ | 114.06° |
| Cell volume | 795.644 Å3 |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| 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. |
1536448.cif |
| 164162 | 2015-10-10 | cif/ Adding structures of 1536448 via cif-deposit CGI script. |
1536448.cif |
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Users of the data should acknowledge the original authors of the
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