Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1537024
Preview
| Coordinates | 1537024.cif |
|---|
| Chemical name | Fe (C (N H2)3)2 (S O4)2 (H2 O)6 |
|---|---|
| Formula | C2 H24 Fe N6 O14 S2 |
| Calculated formula | C2 H24 Fe N6 O14 S2 |
| SMILES | C(=[NH2+])(N)N.[OH2][Fe]([OH2])([OH2])([OH2])([OH2])[OH2].[O-]S(=O)(=O)[O-].C(=[NH2+])(N)N.O=S(=O)([O-])[O-] |
| Title of publication | Structural characterisation of MII guanidinium sulphate hydrates (MII= Mn, Fe, Co, Ni, Cd, V O) |
| Authors of publication | Fleck, M.; Bohaty, L.; Tillmanns, E. |
| Journal of publication | Solid State Sciences |
| Year of publication | 2004 |
| Journal volume | 6 |
| Pages of publication | 469 - 477 |
| a | 10.011 Å |
| b | 7.657 Å |
| c | 12.03 Å |
| α | 90° |
| β | 96.85° |
| γ | 90° |
| Cell volume | 915.568 Å3 |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| 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. |
1537024.cif |
| 164989 | 2015-10-10 | cif/ Adding structures of 1537024 via cif-deposit CGI script. |
1537024.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.