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Information card for entry 7230628
Preview
| Coordinates | 7230628.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | TTF2_complex_block |
|---|---|
| Chemical name | TTF2_complex_block |
| Formula | C30 H16 F4 I5 S8 |
| Calculated formula | C30 H16 F4 I5 S8 |
| Title of publication | A weaker donor shows higher oxidation state upon aggregation |
| Authors of publication | Ma, Longfei; Peng, Haili; Lu, Xiaofeng; Liu, Lei; Shao, Xiangfeng |
| Journal of publication | RSC Advances |
| Year of publication | 2018 |
| Journal volume | 8 |
| Journal issue | 31 |
| Pages of publication | 17321 |
| a | 12.3537 ± 0.0006 Å |
| b | 13.4244 ± 0.001 Å |
| c | 13.8282 ± 0.001 Å |
| α | 61.486 ± 0.007° |
| β | 76.191 ± 0.005° |
| γ | 83.59 ± 0.005° |
| Cell volume | 1956.9 ± 0.3 Å3 |
| Cell temperature | 173 ± 1 K |
| Ambient diffraction temperature | 173 ± 1 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 | 0.0855 |
| Residual factor for significantly intense reflections | 0.0517 |
| Weighted residual factors for significantly intense reflections | 0.106 |
| Weighted residual factors for all reflections included in the refinement | 0.1288 |
| 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 |
| Revision | Date | Message | Files |
|---|---|---|---|
| 207752 (current) | 2018-05-11 | cif/ Adding structures of 7230628, 7230629 via cif-deposit CGI script. |
7230628.cif |
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Users of the data should acknowledge the original authors of the
structural data.