Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2242784
Preview
Coordinates | 2242784.cif |
---|---|
Structure factors | 2242784.hkl |
Original IUCr paper | HTML |
Chemical name | Distrontium palladium trioxide |
---|---|
Formula | O3 Pd Sr2 |
Calculated formula | O3 Pd Sr2 |
SMILES | [Pd]([O-])([O-])O[Pd]([O-])([O-])[O].[Sr+2].[Sr+2].[Sr+2].[Sr+2] |
Title of publication | Redetermination of Sr~2~PdO~3~ from single-crystal X-ray data |
Authors of publication | Thakur, Gohil S.; Reuter, Hans; Felser, Claudia; Jansen, Martin |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2019 |
Journal volume | 75 |
Journal issue | 1 |
Pages of publication | 30 - 32 |
a | 3.5342 ± 0.0002 Å |
b | 3.9822 ± 0.0003 Å |
c | 12.8414 ± 0.0008 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 180.73 ± 0.02 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 3 |
Space group number | 71 |
Hermann-Mauguin space group symbol | I m m m |
Hall space group symbol | -I 2 2 |
Residual factor for all reflections | 0.009 |
Residual factor for significantly intense reflections | 0.009 |
Weighted residual factors for significantly intense reflections | 0.0212 |
Weighted residual factors for all reflections included in the refinement | 0.0212 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.274 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
212552 (current) | 2018-12-12 | cif/ hkl/ Adding structures of 2242784 via cif-deposit CGI script. |
2242784.cif 2242784.hkl |
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.