Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7245061
Preview
| Coordinates | 7245061.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H16 Fe N10 |
|---|---|
| Calculated formula | C20 H16 Fe N10 |
| Title of publication | Topological motifs in dicyanamides of transition metals |
| Authors of publication | Merabet, Layachi; Vologzhanina, Anna V.; Setifi, Zouaoui; Kaboub, Lakhmissi; Setifi, Fatima |
| Journal of publication | CrystEngComm |
| Year of publication | 2022 |
| a | 9.1691 ± 0.0004 Å |
| b | 8.2275 ± 0.0004 Å |
| c | 13.2721 ± 0.0006 Å |
| α | 90° |
| β | 102.521 ± 0.002° |
| γ | 90° |
| Cell volume | 977.42 ± 0.08 Å3 |
| Cell temperature | 170 K |
| Ambient diffraction temperature | 170 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.074 |
| Residual factor for significantly intense reflections | 0.0398 |
| Weighted residual factors for significantly intense reflections | 0.0785 |
| Weighted residual factors for all reflections included in the refinement | 0.1052 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.998 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 276007 (current) | 2022-06-14 | cif/ Adding structures of 7245059, 7245060, 7245061, 7245062, 7245063 via cif-deposit CGI script. |
7245061.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.