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Information card for entry 1575804
Preview
| Coordinates | 1575804.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C81 H77 B F20 N5 Zn |
|---|---|
| Calculated formula | C81 H77 B F20 N5 Zn |
| a | 17.2919 ± 0.0003 Å |
| b | 24.0736 ± 0.0007 Å |
| c | 19.9128 ± 0.0004 Å |
| α | 90° |
| β | 92.305 ± 0.002° |
| γ | 90° |
| Cell volume | 8282.6 ± 0.3 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1695 |
| Residual factor for significantly intense reflections | 0.141 |
| Weighted residual factors for significantly intense reflections | 0.3768 |
| Weighted residual factors for all reflections included in the refinement | 0.4033 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.565 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 302166 (current) | 2025-09-17 | cif/ Adding structures of 1575802, 1575803, 1575804, 1575805, 1575806, 1575807, 1575808 via cif-deposit CGI script. |
1575804.cif |
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Users of the data should acknowledge the original authors of the
structural data.