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Information card for entry 7119138
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| Coordinates | 7119138.cif |
|---|
| Common name | 3PyMeBF3Ph_open |
|---|---|
| Chemical name | Open-ring isomer of a diarylethene |
| Formula | C39 H32 B2 F12 N2 S2 |
| Calculated formula | C39 H32 B2 F12 N2 S2 |
| Title of publication | Photoinduced reversible formation of a superhydrophilic surface by crystal growth of diarylethene |
| Authors of publication | Kazuki Takase; Kengo Hyodo; Masakazu Morimoto; Yuko Kojima; Hiroyuki Mayama; Satoshi Yokojima; Shinichiro Nakamura; Kingo Uchida |
| Journal of publication | Chem.Commun. |
| Year of publication | 2016 |
| Journal volume | 52 |
| Pages of publication | 6885 |
| a | 17.8505 ± 0.0005 Å |
| b | 8.3333 ± 0.0002 Å |
| c | 13.1813 ± 0.0003 Å |
| α | 90° |
| β | 104.671 ± 0.001° |
| γ | 90° |
| Cell volume | 1896.84 ± 0.08 Å3 |
| Cell temperature | 93 ± 2 K |
| Ambient diffraction temperature | 93 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for all reflections | 0.0815 |
| Residual factor for significantly intense reflections | 0.0799 |
| Weighted residual factors for significantly intense reflections | 0.2034 |
| Weighted residual factors for all reflections included in the refinement | 0.2049 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
| Diffraction radiation wavelength | 1.54178 Å |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 185776 (current) | 2016-08-12 | cif/ Adding structures of 7119138, 7119139 via cif-deposit CGI script. |
7119138.cif |
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Users of the data should acknowledge the original authors of the
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