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Information card for entry 7119443
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| Coordinates | 7119443.cif |
|---|
| Chemical name | SPA/TPMA/C70 |
|---|---|
| Formula | C62.5 H45 N O3 S |
| Calculated formula | C62.5 H45 N O3 S |
| Title of publication | Photoinduced electron transfer in porous organic salt crystals impregnated with fullerenes |
| Authors of publication | Tetsuya; Hasegawa; Kei; Ohkubo; Ichiro; Hisaki; Mikiji; Miyata; Norimitsu; Tohnai; Shunichi; Fukuzumi |
| Journal of publication | Chem.Commun. |
| Year of publication | 2016 |
| Journal volume | 52 |
| Pages of publication | 7928 |
| a | 27.3864 ± 0.001 Å |
| b | 27.3864 ± 0.001 Å |
| c | 24.2386 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 18179.3 ± 1 Å3 |
| Cell temperature | 153 K |
| Ambient diffraction temperature | 153 K |
| Number of distinct elements | 5 |
| Space group number | 130 |
| Hermann-Mauguin space group symbol | P 4/n c c |
| Hall space group symbol | -P 4a 2ac |
| Residual factor for all reflections | 0.3169 |
| Residual factor for significantly intense reflections | 0.1293 |
| Weighted residual factors for significantly intense reflections | 0.3439 |
| Weighted residual factors for all reflections included in the refinement | 0.4357 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.19 |
| Diffraction radiation wavelength | 0.8 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 190512 (current) | 2017-01-14 | cif/ Adding structures of 7119441, 7119442, 7119443 via cif-deposit CGI script. |
7119443.cif |
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