Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1550515
Preview
| Coordinates | 1550515.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C130.61 H192.4 As5 Cl19.27 Cr2 Cu13.35 Fe11 N3.83 P55 |
|---|---|
| Calculated formula | C130.61 H192.395 As5 Cl19.27 Cr2 Cu13.35 Fe11 N3.825 P55 |
| Title of publication | From Nano-Balls to Nano-Bowls |
| Authors of publication | Brake, Helena; Presypkina, Eugenia V.; Heindl, Claudia; Virovets, Alexander Viktorovich; Kremer, Werner; Scheer, Manfred |
| Journal of publication | Chemical Science |
| Year of publication | 2019 |
| a | 30.4118 ± 0.0004 Å |
| b | 29.4289 ± 0.0002 Å |
| c | 28.8188 ± 0.0003 Å |
| α | 90° |
| β | 112.875 ± 0.001° |
| γ | 90° |
| Cell volume | 23764 ± 0.5 Å3 |
| Cell temperature | 123 ± 0.3 K |
| Ambient diffraction temperature | 123 ± 0.3 K |
| Number of distinct elements | 9 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor for all reflections | 0.0642 |
| Residual factor for significantly intense reflections | 0.0562 |
| Weighted residual factors for significantly intense reflections | 0.1412 |
| Weighted residual factors for all reflections included in the refinement | 0.1445 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 213266 (current) | 2019-01-24 | cif/ Adding structures of 1550514, 1550515, 1550516 via cif-deposit CGI script. |
1550515.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.