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Information card for entry 1552863
Preview
| Coordinates | 1552863.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H22 Cl4 N4 O4 Zn |
|---|---|
| Calculated formula | C14 H22 Cl4 N4 O4 Zn |
| SMILES | C(=O)(N)c1ccc(cc1)[NH3+].O.O.Cl[Zn](Cl)([Cl-])[Cl-].c1(ccc(cc1)[NH3+])C(=O)N |
| Title of publication | Flexible Thin Film and Bulk Switchable Relaxor Coexisting Most Optimal 473 nm Blue Light without Blue-Light Hazard/Visual Injury |
| Authors of publication | Nie, Yu; Zhang, Zhi-Xu; Shi, Ping-Ping; Zhang, Wan-Ying; Ye, Qiong; Fu, Da-Wei |
| Journal of publication | The Journal of Physical Chemistry C |
| Year of publication | 2019 |
| a | 19.0472 ± 0.0008 Å |
| b | 15.0384 ± 0.0006 Å |
| c | 7.2585 ± 0.0004 Å |
| α | 90° |
| β | 96.774 ± 0.004° |
| γ | 90° |
| Cell volume | 2064.61 ± 0.17 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.095 |
| Residual factor for significantly intense reflections | 0.0889 |
| Weighted residual factors for significantly intense reflections | 0.2471 |
| Weighted residual factors for all reflections included in the refinement | 0.2503 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 227684 (current) | 2019-11-13 | cif/ Adding structures of 1552863 via cif-deposit CGI script. |
1552863.cif |
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