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Information card for entry 1571505
Preview
| Coordinates | 1571505.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C6 H7 F7 N2 O Sb2 |
|---|---|
| Calculated formula | C6 H7 F7 N2 O Sb2 |
| Title of publication | [(C<sub>5</sub>H<sub>6</sub>N<sub>2</sub>)<sub>2</sub>H](Sb<sub>4</sub>F<sub>13</sub>): a polyfluoroantimonite with a strong second harmonic generation effect. |
| Authors of publication | Wu, Jia-Hang; Hu, Chun-Li; Li, Ya-Feng; Mao, Jiang-Gao; Kong, Fang |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 21 |
| Pages of publication | 8071 - 8079 |
| a | 7.3227 ± 0.001 Å |
| b | 7.4727 ± 0.0012 Å |
| c | 11.1037 ± 0.0016 Å |
| α | 75.512 ± 0.013° |
| β | 83.357 ± 0.011° |
| γ | 85.846 ± 0.013° |
| Cell volume | 583.73 ± 0.15 Å3 |
| Cell temperature | 295.68 ± 0.1 K |
| Ambient diffraction temperature | 295.68 ± 0.1 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 | 0.0434 |
| Residual factor for significantly intense reflections | 0.0303 |
| Weighted residual factors for significantly intense reflections | 0.0536 |
| Weighted residual factors for all reflections included in the refinement | 0.062 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.995 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1571505.html
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Users of the data should acknowledge the original authors of the
structural data.