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Information card for entry 7239112
Preview
| Coordinates | 7239112.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C104 H116 F12 N12 O14 Rh4 S4 |
|---|---|
| Calculated formula | C96 H96 F12 N12 O12 Rh4 S4 |
| Title of publication | Size recognition and optical unloading of polyaromatic compounds based on a coordination box containing face-to-face olefin bonds |
| Authors of publication | Wu, Tong; Lin, Yue-Jian; Jin, Guo-Xin |
| Journal of publication | RSC Advances |
| Year of publication | 2013 |
| Journal volume | 3 |
| Journal issue | 29 |
| Pages of publication | 11476 |
| a | 12.9496 ± 0.0002 Å |
| b | 23.8189 ± 0.0004 Å |
| c | 18.5603 ± 0.0004 Å |
| α | 90° |
| β | 97.901 ± 0.001° |
| γ | 90° |
| Cell volume | 5670.49 ± 0.18 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0869 |
| Residual factor for significantly intense reflections | 0.0752 |
| Weighted residual factors for significantly intense reflections | 0.2109 |
| Weighted residual factors for all reflections included in the refinement | 0.2246 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244551 (current) | 2019-11-28 | cif/ Adding structures of 7239110, 7239111, 7239112, 7239113 via cif-deposit CGI script. |
7239112.cif |
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Users of the data should acknowledge the original authors of the
structural data.