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Information card for entry 7248142
Preview
Coordinates | 7248142.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C85 H8 F24 O3 |
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Calculated formula | C78 F24 O3 |
Title of publication | Oxidative cage opening in the C<sub>70</sub> fullerene facilitated by preceding trifluoromethylation. |
Authors of publication | Gracheva, Sofia V.; Tamm, Nadezhda B.; Lyssenko, Konstantin A.; Ioffe, Ilya N.; Lukonina, Natalia S.; Goryunkov, Alexey A. |
Journal of publication | Physical chemistry chemical physics : PCCP |
Year of publication | 2024 |
Journal volume | 26 |
Journal issue | 10 |
Pages of publication | 8038 - 8042 |
a | 11.2201 ± 0.0004 Å |
b | 22.3582 ± 0.0008 Å |
c | 21.7383 ± 0.0008 Å |
α | 90° |
β | 101.343 ± 0.0012° |
γ | 90° |
Cell volume | 5346.8 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1234 |
Residual factor for significantly intense reflections | 0.0693 |
Weighted residual factors for significantly intense reflections | 0.1591 |
Weighted residual factors for all reflections included in the refinement | 0.1847 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.97 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7248142.html
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