Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7711827
Preview
| Coordinates | 7711827.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Al Ca2 P3 Pt7 |
|---|---|
| Calculated formula | Al Ca2 P3 Pt7 |
| Title of publication | Merging the AuCu3- and BaAl4-based structure motifs: flux-assisted synthesis, crystal, and electronic structure of Ca2Pt7XP4-δ phosphide platinides (X=Al, Ti, and Zn) |
| Authors of publication | Makhaneva, Anastasiya Yu; Zakharova, Elena Yu; Nesterenko, Sergey N.; Lyssenko, Konstantin; Kuznetsov, Alexey N. |
| Journal of publication | Dalton Transactions |
| Year of publication | 2022 |
| a | 3.9893 ± 0.0006 Å |
| b | 3.9893 ± 0.0006 Å |
| c | 26.832 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 427.02 ± 0.12 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 139 |
| Hermann-Mauguin space group symbol | I 4/m m m |
| Hall space group symbol | -I 4 2 |
| Residual factor for all reflections | 0.0285 |
| Residual factor for significantly intense reflections | 0.0248 |
| Weighted residual factors for significantly intense reflections | 0.0526 |
| Weighted residual factors for all reflections included in the refinement | 0.0541 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 279518 (current) | 2022-11-24 | cif/ Adding structures of 7711827, 7711828, 7711829 via cif-deposit CGI script. |
7711827.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.