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Information card for entry 7245321
Preview
| Coordinates | 7245321.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H24 S8 |
|---|---|
| Calculated formula | C18 H24 S8 |
| Title of publication | Chiral diethyl-EDT-TTF and tetraethyl-BEDT-TTF: synthesis, structural characterization, radical cation salt and charge transfer complexes |
| Authors of publication | Mroweh, Nabil; Cauchy, Thomas; Vanthuyne, Nicolas; Avarvari, Narcis |
| Journal of publication | CrystEngComm |
| Year of publication | 2022 |
| a | 13.7056 ± 0.0002 Å |
| b | 13.7056 ± 0.0002 Å |
| c | 23.9209 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4493.38 ± 0.13 Å3 |
| Cell temperature | 150 ± 0.1 K |
| Ambient diffraction temperature | 150 ± 0.1 K |
| Number of distinct elements | 3 |
| Space group number | 92 |
| Hermann-Mauguin space group symbol | P 41 21 2 |
| Hall space group symbol | P 4abw 2nw |
| Residual factor for all reflections | 0.0579 |
| Residual factor for significantly intense reflections | 0.0486 |
| Weighted residual factors for significantly intense reflections | 0.1004 |
| Weighted residual factors for all reflections included in the refinement | 0.1045 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.153 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 277262 (current) | 2022-08-17 | cif/ Adding structures of 7245316, 7245317, 7245318, 7245319, 7245320, 7245321, 7245322, 7245323, 7245324, 7245325 via cif-deposit CGI script. |
7245321.cif |
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Users of the data should acknowledge the original authors of the
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