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Information card for entry 1523034
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| Coordinates | 1523034.cif |
|---|
| Chemical name | Fe (S C (N H2)2)2 (N C S)2 |
|---|---|
| Formula | C4 H8 Fe N6 S4 |
| Calculated formula | C4 H8 Fe N6 S4 |
| SMILES | C(N)(N)=[S]1[Fe](N=C=S)(N=C=S)[S](=C(N)N)[Fe]21(N=C=S)(N=C=S)[S](=C(N)N)[Fe](N=C=S)(N=C=S)([S]=C(N)N)([S]=C(N)N)[S]2=C(N)N |
| Title of publication | The crystal and molecular structure of bis(thiourea)iron(II) thiocyanate |
| Authors of publication | Valle, G.; Russo, U.; Calogero, S. |
| Journal of publication | Transition Metal Chemistry |
| Year of publication | 1980 |
| Journal volume | 5 |
| Pages of publication | 26 - 29 |
| a | 10.114 Å |
| b | 7.662 Å |
| c | 3.897 Å |
| α | 105° |
| β | 81.8° |
| γ | 96.4° |
| Cell volume | 287.84 Å3 |
| Number of distinct elements | 5 |
| 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. |
1523034.cif |
| 143366 | 2015-07-10 | cif/ Adding structures of 1523034 via cif-deposit CGI script. |
1523034.cif |
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Users of the data should acknowledge the original authors of the
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