Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2107540
Preview
| Coordinates | 2107540.cif |
|---|---|
| Structure factors | 2107540.hkl |
| Original IUCr paper | HTML |
| Common name | Indium Sulphide |
|---|---|
| Formula | In1.95 S3 |
| Calculated formula | In1.946 S3 |
| Title of publication | Structure reinvestigation of α-, β- and γ-In~2~S~3~ |
| Authors of publication | Pistor, Paul; Merino Álvarez, Jose M.; León, Máximo; di Michiel, Marco; Schorr, Susan; Klenk, Reiner; Lehmann, Sebastian |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2016 |
| Journal volume | 72 |
| Journal issue | 3 |
| Pages of publication | 410 - 415 |
| a | 3.86564 ± 0.00014 Å |
| b | 3.86564 ± 0.00014 Å |
| c | 9.1569 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 118.501 ± 0.009 Å3 |
| Cell temperature | 1099 K |
| Ambient diffraction temperature | 1099 K |
| Number of distinct elements | 2 |
| Space group number | 164 |
| Hermann-Mauguin space group symbol | P -3 m 1 |
| Hall space group symbol | -P 3 2" |
| Residual factor R(I) for significantly intense reflections | 0.027529 |
| Goodness-of-fit parameter for all reflections | 3.302 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 0.14276 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 183117 (current) | 2016-05-28 | cif/ hkl/ Adding structures of 2107538, 2107539, 2107540 via cif-deposit CGI script. |
2107540.cif 2107540.hkl |
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.