Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4329645
Preview
| Coordinates | 4329645.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | iron selenide |
|---|---|
| Formula | Fe Se |
| Calculated formula | Fe Se |
| SMILES | [Se-2].[Fe+2] |
| Title of publication | Room-Temperature Synthesis, Hydrothermal Recrystallization, and Properties of Metastable Stoichiometric FeSe |
| Authors of publication | Fabian Nitsche; Til Goltz; Hans-Henning Klauss; Anna Isaeva; Ulrike Müller; Walter Schnelle; Paul Simon; Thomas Doert; Michael Ruck |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2012 |
| Journal volume | 51 |
| Pages of publication | 7370 - 7376 |
| a | 3.779 ± 0.0001 Å |
| b | 3.779 ± 0.0001 Å |
| c | 5.5111 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 78.703 ± 0.005 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 2 |
| Space group number | 129 |
| Hermann-Mauguin space group symbol | P 4/n m m :1 |
| Hall space group symbol | P 4ab 2ab -1ab |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 1.5406 Å |
| Diffraction radiation type | CuKα~1~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179399 (current) | 2016-03-23 | cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/96. |
4329645.cif |
| 78702 | 2013-04-02 | cif/ Adding structures of 4329645 via cif-deposit CGI script. |
4329645.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.