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Information card for entry 4132505
Preview
| Coordinates | 4132505.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C49 H35 F12 O2 |
|---|---|
| Calculated formula | C49 H35 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 | 16.2853 ± 0.0008 Å |
| b | 15.2445 ± 0.0007 Å |
| c | 17.0808 ± 0.0009 Å |
| α | 90° |
| β | 107.963 ± 0.001° |
| γ | 90° |
| Cell volume | 4033.8 ± 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 | 0.1174 |
| Residual factor for significantly intense reflections | 0.0703 |
| Weighted residual factors for significantly intense reflections | 0.1725 |
| Weighted residual factors for all reflections included in the refinement | 0.2055 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 242479 (current) | 2019-11-26 | cif/ Adding structures of 4132505 via cif-deposit CGI script. |
4132505.cif |
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Users of the data should acknowledge the original authors of the
structural data.