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Information card for entry 2021117
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| Coordinates | 2021117.cif |
|---|---|
| Structure factors | 2021117.hkl |
| Original paper (by DOI) | HTML |
| Common name | thallium iron bis(hydrogen arsenate) |
|---|---|
| Chemical name | Thallium iron bis[hydrogen arsenate(V)] |
| Formula | As2 Fe H2 O8 Tl |
| Calculated formula | As2 Fe H2 O8 Tl0.999867 |
| Title of publication | RbFe(HAsO4)2 and TlFe(HAsO4)2, two new hydrogenarsenates adopting two closely related structure types |
| Authors of publication | Schwendtner, Karolina; Kolitsch, Uwe |
| Journal of publication | Acta Crystallographica Section E Crystallographic Communications |
| Year of publication | 2018 |
| Journal volume | 74 |
| Journal issue | 6 |
| Pages of publication | 766 |
| a | 7.346 ± 0.002 Å |
| b | 9.148 ± 0.002 Å |
| c | 9.662 ± 0.002 Å |
| α | 64.89 ± 0.03° |
| β | 70.51 ± 0.03° |
| γ | 69.94 ± 0.03° |
| Cell volume | 538.6 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0293 |
| Residual factor for significantly intense reflections | 0.0224 |
| Weighted residual factors for significantly intense reflections | 0.0487 |
| Weighted residual factors for all reflections included in the refinement | 0.0508 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 207602 (current) | 2018-05-01 | cif/ hkl/ Adding structures of 2021116, 2021117 via cif-deposit CGI script. |
2021117.cif 2021117.hkl |
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