Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4341743
Preview
| Coordinates | 4341743.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Cl Cs K2 Mn3 O14 P4 |
|---|---|
| Calculated formula | Cl Cs K2 Mn3 O14 P4 |
| Title of publication | M3(P2O7)2(2-)-Type Open Frameworks Featuring [M2O8] and [M3O12] Multinuclear Transition-Metal Oxide Units. Serendipitous Synthesis of Six Polymorphic Salt-Inclusion Magnetic Solids: Na2M3(P2O7)2·ACl (M = Mn, Fe; A = Rb, Cs) and K2M3(P2O7)2·CsCl (M = Fe, Mn). |
| Authors of publication | Gao, Jianhua; Li, Jian; Sulejmanovic, Dino; Hwu, Shiou-Jyh |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2015 |
| Journal volume | 54 |
| Journal issue | 3 |
| Pages of publication | 1136 - 1144 |
| a | 7.6288 ± 0.0015 Å |
| b | 5.3699 ± 0.0011 Å |
| c | 18.995 ± 0.004 Å |
| α | 90° |
| β | 100.92 ± 0.03° |
| γ | 90° |
| Cell volume | 764.1 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for all reflections | 0.0313 |
| Residual factor for significantly intense reflections | 0.0304 |
| Weighted residual factors for significantly intense reflections | 0.0787 |
| Weighted residual factors for all reflections included in the refinement | 0.0796 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.115 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179520 (current) | 2016-03-23 | cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/17. |
4341743.cif |
| 130555 | 2015-02-04 | cif/ Updating files of 4341739, 4341740, 4341741, 4341742, 4341743, 4341744 Original log message: Adding full bibliography for 4341739--4341744.cif. |
4341743.cif |
| 127824 | 2014-11-22 | cif/ Adding structures of 4341739, 4341740, 4341741, 4341742, 4341743, 4341744 via cif-deposit CGI script. |
4341743.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.