Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1557260
Preview
| Coordinates | 1557260.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | mer-[Cr(NH3)3(N3)3} |
|---|---|
| Formula | Cr H9 N12 |
| Calculated formula | Cr N12 |
| SMILES | [Cr]([NH3])([NH3])([NH3])(N=N#N)(N=N#N)N=N#N |
| Title of publication | Crystal Structures and Nitrosation Reactions of Triamminetriazido Complexes of Chromium(III) |
| Authors of publication | Dossing, Anders; Engberg, Pernille; Hazell, Rita |
| Journal of publication | Acta Chemica Scandinavica |
| Year of publication | 1997 |
| Journal volume | 51 |
| Pages of publication | 849 - 854 |
| a | 7.661 ± 0.002 Å |
| b | 10.19 ± 0.003 Å |
| c | 5.807 ± 0.002 Å |
| α | 93.58 ± 0.01° |
| β | 101.37 ± 0.02° |
| γ | 81.3 ± 0.2° |
| Cell volume | 439.1 ± 0.3 Å3 |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 3 |
| Space group number | 1 |
| Hermann-Mauguin space group symbol | P 1 |
| Hall space group symbol | P 1 |
| Residual factor for significantly intense reflections | 0.054 |
| Weighted residual factors for significantly intense reflections | 0.067 |
| Goodness-of-fit parameter for all reflections included in the refinement | 4.11 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 247911 (current) | 2020-02-06 | cif/ Adding structures of 1557260 via cif-deposit CGI script. |
1557260.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.