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Information card for entry 1549466
Preview
| Coordinates | 1549466.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H22.2 O2 |
|---|---|
| Calculated formula | C37.996 H22.2 O1.9992 |
| Title of publication | Stepwise photochromism of bisnaphthopyrans exhibiting an excitation intensity-dependent color change. |
| Authors of publication | Inagaki, Yuki; Mutoh, Katsuya; Abe, Jiro |
| Journal of publication | Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology |
| Year of publication | 2018 |
| Journal volume | 17 |
| Journal issue | 7 |
| Pages of publication | 946 - 953 |
| a | 7.538 ± 0.002 Å |
| b | 9.367 ± 0.003 Å |
| c | 18.374 ± 0.005 Å |
| α | 90° |
| β | 100.039 ± 0.004° |
| γ | 90° |
| Cell volume | 1277.5 ± 0.6 Å3 |
| Cell temperature | 90 K |
| Ambient diffraction temperature | 90 K |
| Number of distinct elements | 3 |
| 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 | 0.0993 |
| Residual factor for significantly intense reflections | 0.074 |
| Weighted residual factors for significantly intense reflections | 0.1853 |
| Weighted residual factors for all reflections included in the refinement | 0.2043 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 230896 (current) | 2019-11-17 | cif/ Updating files of 1549466 Original log message: Adding full bibliography for 1549466.cif. |
1549466.cif |
| 207983 | 2018-05-25 | cif/ Adding structures of 1549466 via cif-deposit CGI script. |
1549466.cif |
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Users of the data should acknowledge the original authors of the
structural data.