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Information card for entry 1562953
Preview
| Coordinates | 1562953.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | B3 Ir1.94 Rh2.38 Ti1.68 |
|---|---|
| Calculated formula | B3 Ir1.946 Rh2.377 Ti1.677 |
| Title of publication | The complex metal-rich boride Ti1+xRh2−x+yIr3−yB3 (x=0.68, y=1.06) with a new structure type containing B4 zigzag fragments: Synthesis, crystal chemistry and theoretical calculations |
| Authors of publication | Goerens, Christian; Fokwa, Boniface P.T. |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 2012 |
| Journal volume | 192 |
| Pages of publication | 113 - 119 |
| a | 8.62 ± 0.001 Å |
| b | 14.9947 ± 0.0017 Å |
| c | 3.2337 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 417.97 ± 0.09 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 55 |
| Hermann-Mauguin space group symbol | P b a m |
| Hall space group symbol | -P 2 2ab |
| Residual factor for all reflections | 0.0577 |
| Residual factor for significantly intense reflections | 0.0479 |
| Weighted residual factors for significantly intense reflections | 0.09 |
| Weighted residual factors for all reflections included in the refinement | 0.0931 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.158 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 265581 (current) | 2021-05-28 | cif/ Adding structures of 1562953 via cif-deposit CGI script. |
1562953.cif |
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Users of the data should acknowledge the original authors of the
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