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Information card for entry 7708515
Preview
| Coordinates | 7708515.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | B2 Ba F2 O6 Zn3 |
|---|---|
| Calculated formula | B2 Ba F2 O6 Zn3 |
| Title of publication | BaZn<sub>3</sub>(BO<sub>3</sub>)<sub>2</sub>F<sub>2</sub>: a new beryllium-free zincoborate with a KBBF-type structure. |
| Authors of publication | Qiu, Haotian; Xia, Ming; Cai, Wenbing; Yang, Zhihua; Liu, Yanli; Mutailipu, Miriding; Pan, Shilie |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2021 |
| Journal volume | 50 |
| Journal issue | 38 |
| Pages of publication | 13216 - 13219 |
| a | 4.89 ± 0.0005 Å |
| b | 4.89 ± 0.0005 Å |
| c | 7.7146 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 159.76 ± 0.03 Å3 |
| Cell temperature | 300 K |
| Ambient diffraction temperature | 300 K |
| Number of distinct elements | 5 |
| Space group number | 147 |
| Hermann-Mauguin space group symbol | P -3 |
| Hall space group symbol | -P 3 |
| Residual factor for all reflections | 0.0102 |
| Residual factor for significantly intense reflections | 0.0098 |
| Weighted residual factors for significantly intense reflections | 0.0245 |
| Weighted residual factors for all reflections included in the refinement | 0.0245 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.218 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 269803 (current) | 2021-10-07 | cif/ Adding structures of 7708515 via cif-deposit CGI script. |
7708515.cif |
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