Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2241949
Preview
Coordinates | 2241949.cif |
---|---|
Structure factors | 2241949.hkl |
Original IUCr paper | HTML |
Common name | Na2 Ca Mn Fe (P O4)3 |
---|---|
Chemical name | Disodium calcium manganese iron tris(phosphate) |
Formula | Ca Fe Mn Na2 O12 P3 |
Calculated formula | Ca Fe1.0002 Mn0.9998 Na2 O12 P3 |
Title of publication | Synthesis and crystal structure of a new alluaudite-like iron phosphate Na~2~CaMnFe(PO~4~)~3~ |
Authors of publication | Jebli, Semeh; Badri, Abdessalem; Ben Amara, Mongi |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2016 |
Journal volume | 72 |
Journal issue | 12 |
Pages of publication | 1806 - 1808 |
a | 12.283 ± 0.001 Å |
b | 12.736 ± 0.001 Å |
c | 6.494 ± 0.005 Å |
α | 90° |
β | 114.76 ± 0.03° |
γ | 90° |
Cell volume | 922.5 ± 0.8 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0376 |
Residual factor for significantly intense reflections | 0.0281 |
Weighted residual factors for significantly intense reflections | 0.0764 |
Weighted residual factors for all reflections included in the refinement | 0.0806 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
188494 (current) | 2016-11-16 | cif/ hkl/ Adding structures of 2241949 via cif-deposit CGI script. |
2241949.cif 2241949.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.