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Information card for entry 7119127
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| Coordinates | 7119127.cif |
|---|
| Chemical name | by-product 2 |
|---|---|
| Formula | C31 H19.46 Cl0.08 N2 O |
| Calculated formula | C31 H19.4583 Cl0.0835 N2 O |
| Title of publication | Stealth fast photoswitching of negative photochromic naphthalene-bridged phenoxyl-imidazolyl radical complexes |
| Authors of publication | Katsuya Mutoh; Yoichi Kobayashi; Yasukazu Hirao; Takashi Kubo; Jiro Abe |
| Journal of publication | Chem.Commun. |
| Year of publication | 2016 |
| Journal volume | 52 |
| Pages of publication | 6797 |
| a | 15.6018 ± 0.0016 Å |
| b | 11.8059 ± 0.0012 Å |
| c | 23.666 ± 0.002 Å |
| α | 90° |
| β | 100.492 ± 0.0012° |
| γ | 90° |
| Cell volume | 4286.2 ± 0.7 Å3 |
| Cell temperature | 90 K |
| Ambient diffraction temperature | 90 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0577 |
| Residual factor for significantly intense reflections | 0.0415 |
| Weighted residual factors for significantly intense reflections | 0.101 |
| Weighted residual factors for all reflections included in the refinement | 0.1098 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.068 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 185772 (current) | 2016-08-12 | cif/ Adding structures of 7119124, 7119125, 7119126, 7119127 via cif-deposit CGI script. |
7119127.cif |
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Users of the data should acknowledge the original authors of the
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