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Information card for entry 7123830
Preview
| Coordinates | 7123830.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C74 H56 F16 N12 O4 |
|---|---|
| Calculated formula | C74 H56 F16 N12 O4 |
| Title of publication | Solvation-Dependent Switching of Solid-state Luminescence of a Fluorinated Aromatic Tetrapyrazole |
| Authors of publication | Zhang, Zhenglin; Lieu, Thien; Wu, Chia-Hua; Wang, Xiqu; Wu, Judy I-Chia; Daugulis, Olafs; Miljanic, Ognjen Š. |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 17.4361 ± 0.0003 Å |
| b | 20.2383 ± 0.0004 Å |
| c | 21.2515 ± 0.0004 Å |
| α | 88.976 ± 0.001° |
| β | 72.805 ± 0.001° |
| γ | 70.255 ± 0.001° |
| Cell volume | 6714.7 ± 0.2 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0917 |
| Residual factor for significantly intense reflections | 0.0669 |
| Weighted residual factors for significantly intense reflections | 0.1771 |
| Weighted residual factors for all reflections included in the refinement | 0.1994 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216939 (current) | 2019-07-11 | cif/ Adding structures of 7123829, 7123830 via cif-deposit CGI script. |
7123830.cif |
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Users of the data should acknowledge the original authors of the
structural data.