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Information card for entry 4132504
Preview
| Coordinates | 4132504.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C47 H30 F12 O2 |
|---|---|
| Calculated formula | C47 H30 F12 O2 |
| Title of publication | Helically Locked Tethered Twistacenes. |
| Authors of publication | Bedi, Anjan; Shimon, Linda J. W.; Gidron, Ori |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2018 |
| Journal volume | 140 |
| Journal issue | 26 |
| Pages of publication | 8086 - 8090 |
| a | 15.2965 ± 0.0002 Å |
| b | 15.9067 ± 0.0003 Å |
| c | 16.5026 ± 0.0003 Å |
| α | 73.197 ± 0.001° |
| β | 88.851 ± 0.001° |
| γ | 78.149 ± 0.001° |
| Cell volume | 3758.68 ± 0.11 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0598 |
| Residual factor for significantly intense reflections | 0.0484 |
| Weighted residual factors for significantly intense reflections | 0.1291 |
| Weighted residual factors for all reflections included in the refinement | 0.1366 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 242478 (current) | 2019-11-26 | cif/ Adding structures of 4132504 via cif-deposit CGI script. |
4132504.cif |
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Users of the data should acknowledge the original authors of the
structural data.