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Information card for entry 4348978
Preview
| Coordinates | 4348978.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | B5 Ba K O9 |
|---|---|
| Calculated formula | B5 Ba K O9 |
| Title of publication | Effects of the Orientation of [B<sub>5</sub>O<sub>11</sub>]<sup>7-</sup> Fundamental Building Blocks on Layered Structures Based on the Pentaborates. |
| Authors of publication | Mutailipu, Miriding; Zhang, Min; Dong, Xiaoyu; Chen, Yanna; Pan, Shilie |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2016 |
| Journal volume | 55 |
| Journal issue | 20 |
| Pages of publication | 10608 - 10616 |
| a | 6.668 ± 0.004 Å |
| b | 14.511 ± 0.009 Å |
| c | 8.419 ± 0.005 Å |
| α | 90° |
| β | 105.087 ± 0.007° |
| γ | 90° |
| Cell volume | 786.5 ± 0.8 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0973 |
| Residual factor for significantly intense reflections | 0.0508 |
| Weighted residual factors for significantly intense reflections | 0.1183 |
| Weighted residual factors for all reflections included in the refinement | 0.1652 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.998 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 233522 (current) | 2019-11-23 | cif/ Adding structures of 4348978 via cif-deposit CGI script. |
4348978.cif |
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Users of the data should acknowledge the original authors of the
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