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Information card for entry 4002670
Preview
| Coordinates | 4002670.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Cl La3 P6 Zn4 |
|---|---|
| Calculated formula | Cl La3 P6 Zn4 |
| Title of publication | Enclathration of X@La4Tetrahedra in Channels of Zn‒P Frameworks in La3Zn4P6X (X = Cl, Br) |
| Authors of publication | Wang, Jian; Kaseman, Derrick; Lee, Kathleen; Sen, Sabyasachi; Kovnir, Kirill |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2016 |
| Journal volume | 28 |
| Journal issue | 13 |
| Pages of publication | 4741 |
| a | 4.0576 ± 0.0005 Å |
| b | 13.6319 ± 0.0016 Å |
| c | 21.547 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1191.8 ± 0.3 Å3 |
| Cell temperature | 90 ± 2 K |
| Ambient diffraction temperature | 90 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 63 |
| Hermann-Mauguin space group symbol | C m c m |
| Hall space group symbol | -C 2c 2 |
| Residual factor for all reflections | 0.0444 |
| Residual factor for significantly intense reflections | 0.0313 |
| Weighted residual factors for significantly intense reflections | 0.0598 |
| Weighted residual factors for all reflections included in the refinement | 0.0644 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 184804 (current) | 2016-08-04 | cif/ Adding structures of 4002670 via cif-deposit CGI script. |
4002670.cif |
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