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Information card for entry 5000322
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| Coordinates | 5000322.cif |
|---|
| Formula | C26 H24 B Cu2 F5 N4 O4 |
|---|---|
| Calculated formula | C26.48 H23.5 B Cu2 F5 N5.89 O4 |
| a | 12.613 ± 0.003 Å |
| b | 13.38 ± 0.003 Å |
| c | 9.763 ± 0.002 Å |
| α | 105.41 ± 0.01° |
| β | 110.483 ± 0.01° |
| γ | 102.894 ± 0.012° |
| Cell volume | 1393.8 ± 0.5 Å3 |
| Cell temperature | 103 K |
| Ambient diffraction temperature | 20 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 significantly intense reflections | 0.0659 |
| Weighted residual factors for all reflections included in the refinement | 0.05 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.9453 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.