Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1557147
Preview
| Coordinates | 1557147.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Copper(II) Adamanzane Complex |
|---|---|
| Formula | C11 H24 Br Cl Cu N4 O4 |
| Calculated formula | C11 Br Cl Cu N4 O4 |
| Title of publication | Synthetic, Thermodynamic and Crystallographic Studies of Pentacoordinated Copper(II) Complexes with [24.31]Adamanzane, 1,4,7,10-Tetraazabicyclo[5.5.3]pentadecane, and Bromide, Iodide, Hydroxide, Water or Ammonia |
| Authors of publication | Springborg, Johan; Sotofte, Inger |
| Journal of publication | Acta Chemica Scandinavica |
| Year of publication | 1997 |
| Journal volume | 51 |
| Pages of publication | 357 - 366 |
| a | 8.097 ± 0.003 Å |
| b | 22.75 ± 0.009 Å |
| c | 8.983 ± 0.003 Å |
| α | 90° |
| β | 94.21 ± 0.03° |
| γ | 90° |
| Cell volume | 1650.3 ± 1.1 Å3 |
| Ambient diffraction temperature | 120 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for significantly intense reflections | 0.0764 |
| Weighted residual factors for all reflections included in the refinement | 0.1828 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1 |
| 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 |
|---|---|---|---|
| 247187 (current) | 2020-01-24 | cif/ Adding structures of 1557147 via cif-deposit CGI script. |
1557147.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.