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Information card for entry 4518714
Preview
| Coordinates | 4518714.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H22 Br2 O2 |
|---|---|
| Calculated formula | C25 H22 Br2 O2 |
| Title of publication | Controlled Polymerization of Norbornene Cycloparaphenylenes Expands Carbon Nanomaterials Design Space |
| Authors of publication | Maust, Ruth L.; Li, Penghao; Shao, Baihao; Zeitler, Sarah M.; Sun, Peiguan B.; Reid, Harrison W.; Zakharov, Lev N.; Golder, Matthew R.; Jasti, Ramesh |
| Journal of publication | ACS Central Science |
| Year of publication | 2021 |
| a | 12.3702 ± 0.0005 Å |
| b | 15.2429 ± 0.0006 Å |
| c | 12.0344 ± 0.0004 Å |
| α | 90° |
| β | 112.703 ± 0.001° |
| γ | 90° |
| Cell volume | 2093.36 ± 0.14 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 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 | 0.0344 |
| Residual factor for significantly intense reflections | 0.0313 |
| Weighted residual factors for significantly intense reflections | 0.0848 |
| Weighted residual factors for all reflections included in the refinement | 0.087 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 265188 (current) | 2021-05-14 | cif/ Adding structures of 4518714 via cif-deposit CGI script. |
4518714.cif |
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Users of the data should acknowledge the original authors of the
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