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Information card for entry 1569099
Preview
| Coordinates | 1569099.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C66 H128 K N12 O1.5 P2 S4 Si2 |
|---|---|
| Calculated formula | C60 H113 K N12 P2 S4 Si2 |
| a | 14.1993 ± 0.0006 Å |
| b | 17.4995 ± 0.0007 Å |
| c | 18.3108 ± 0.0008 Å |
| α | 64.358 ± 0.002° |
| β | 77.924 ± 0.002° |
| γ | 85.049 ± 0.002° |
| Cell volume | 4011 ± 0.3 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0407 |
| Residual factor for significantly intense reflections | 0.0368 |
| Weighted residual factors for significantly intense reflections | 0.1025 |
| Weighted residual factors for all reflections included in the refinement | 0.1058 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 283668 (current) | 2023-05-11 | cif/ Adding structures of 1569096, 1569097, 1569098, 1569099, 1569100, 1569101 via cif-deposit CGI script. |
1569099.cif |
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Users of the data should acknowledge the original authors of the
structural data.