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Information card for entry 7135040
Preview
| Coordinates | 7135040.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C H9 B3 F2 N4 O5 |
|---|---|
| Calculated formula | C H9 B3 F2 N4 O5 |
| Title of publication | CN<sub>4</sub>H<sub>7</sub>B<sub>3</sub>O<sub>3</sub>F<sub>2</sub>(OH)<sub>2</sub>: short-wave UV hydroxyfluorooxyborate crystals with large birefringence. |
| Authors of publication | Shen, Chunjie; Zhou, Huan; Hu, Chenhui; Yang, Zhihua; Zhang, Feng; Pan, Shilie |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2025 |
| Journal volume | 61 |
| Journal issue | 87 |
| Pages of publication | 16997 - 17000 |
| a | 7.2945 ± 0.0018 Å |
| b | 7.969 ± 0.002 Å |
| c | 8.237 ± 0.002 Å |
| α | 107.653 ± 0.009° |
| β | 101.435 ± 0.009° |
| γ | 95.312 ± 0.009° |
| Cell volume | 441.19 ± 0.19 Å3 |
| Cell temperature | 296.15 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0718 |
| Residual factor for significantly intense reflections | 0.0429 |
| Weighted residual factors for significantly intense reflections | 0.1002 |
| Weighted residual factors for all reflections included in the refinement | 0.1189 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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The link is: https://www.crystallography.net/7135040.html
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