Information card for entry 1559175
Chemical name |
2-Hcation |
Formula |
C32 H41 B Cl2 F4 N4 O2 |
Calculated formula |
C32 H41 B Cl2 F4 N4 O2 |
Title of publication |
Persistent, highly localized, and tunable [4]helicene radicals |
Authors of publication |
Shaikh, Aslam C.; Moutet, Jules; Veleta, José M.; Hossain, Md Mubarak; Bloch, Jan; Astashkin, Andrei V.; Gianetti, Thomas L. |
Journal of publication |
Chemical Science |
Year of publication |
2020 |
a |
11.511 ± 0.0003 Å |
b |
12.4254 ± 0.0003 Å |
c |
13.1831 ± 0.0003 Å |
α |
85.106 ± 0.0018° |
β |
78.778 ± 0.002° |
γ |
64.945 ± 0.003° |
Cell volume |
1675.47 ± 0.08 Å3 |
Cell temperature |
100.01 ± 0.1 K |
Ambient diffraction temperature |
100 K |
Number of distinct elements |
7 |
Space group number |
2 |
Hermann-Mauguin space group symbol |
P -1 |
Hall space group symbol |
-P 1 |
Residual factor for all reflections |
0.0507 |
Residual factor for significantly intense reflections |
0.0459 |
Weighted residual factors for significantly intense reflections |
0.1033 |
Weighted residual factors for all reflections included in the refinement |
0.106 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.0699 |
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/1559175.html