Information card for entry 7127665
| Formula |
C20 H30 F6 N2 O6 S2 |
| Calculated formula |
C20 H30 F6 N2 O6 S2 |
| Title of publication |
Tethered CAAC-CAAC dimers: oxidation to persistent radical cations and bridging-unit dependent reactivity/stability of the dications. |
| Authors of publication |
Nayak, Mithilesh Kumar; Suhr, Simon; Chrysochos, Nicolas; Rawat, Hemant; Schulzke, Carola; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul |
| Journal of publication |
Chemical communications (Cambridge, England) |
| Year of publication |
2021 |
| Journal volume |
57 |
| Journal issue |
10 |
| Pages of publication |
1210 - 1213 |
| a |
10.4927 ± 0.0003 Å |
| b |
11.3753 ± 0.0004 Å |
| c |
12.8459 ± 0.0004 Å |
| α |
67.712 ± 0.003° |
| β |
72.257 ± 0.003° |
| γ |
66.569 ± 0.003° |
| Cell volume |
1280.14 ± 0.08 Å3 |
| Cell temperature |
120 ± 2 K |
| Ambient diffraction temperature |
120 ± 2 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 |
0.0646 |
| Residual factor for significantly intense reflections |
0.0502 |
| Weighted residual factors for significantly intense reflections |
0.1243 |
| Weighted residual factors for all reflections included in the refinement |
0.1317 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.11 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7127665.html
