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Information card for entry 4348365
Preview
| Coordinates | 4348365.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C0 H3 B6 Bi3 O15 |
|---|---|
| Calculated formula | B6 Bi3 H3 O15 |
| Title of publication | An outstanding second-harmonic generation material BiB2O4F: exploiting the electron-withdrawing ability of fluorine |
| Authors of publication | Cong, Rihong; Wang, Ying; Kang, Lei; Zhou, Zhengyang; Lin, Zheshuai; Yang, Tao |
| Journal of publication | Inorganic Chemistry Frontiers |
| Year of publication | 2015 |
| Journal volume | 2 |
| Journal issue | 2 |
| Pages of publication | 170 |
| a | 6.62214 ± 0.0001 Å |
| b | 6.62214 ± 0.0001 Å |
| c | 6.65264 ± 0.0001 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 252.651 ± 0.007 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 144 |
| Hermann-Mauguin space group symbol | P 31 |
| Hall space group symbol | P 31 |
| Residual factor for all reflections | 0.0443 |
| Residual factor for significantly intense reflections | 0.0418 |
| Weighted residual factors for significantly intense reflections | 0.0915 |
| Weighted residual factors for all reflections included in the refinement | 0.0934 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.018 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 232888 (current) | 2019-11-23 | cif/ Adding structures of 4348365 via cif-deposit CGI script. |
4348365.cif |
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