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Information card for entry 7234895
Preview
| Coordinates | 7234895.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H27 N3 O S |
|---|---|
| Calculated formula | C41 H30 N3 O S |
| Title of publication | Trend breaking substitution pattern of phenothiazine with acceptors as a rational design platform for blue emitters |
| Authors of publication | Sunil Kumar; Meenu Singh; Jwo-Huei Jou; Subrata Ghosh |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2016 |
| Journal volume | 4 |
| Pages of publication | 6769 - 6777 |
| a | 10.1788 ± 0.0005 Å |
| b | 12.4494 ± 0.0007 Å |
| c | 12.8652 ± 0.0006 Å |
| α | 67.749 ± 0.005° |
| β | 85.414 ± 0.004° |
| γ | 78.057 ± 0.005° |
| Cell volume | 1476.21 ± 0.14 Å3 |
| Cell temperature | 150 ± 0.1 K |
| Ambient diffraction temperature | 150 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0758 |
| Residual factor for significantly intense reflections | 0.0662 |
| Weighted residual factors for significantly intense reflections | 0.1728 |
| Weighted residual factors for all reflections included in the refinement | 0.181 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.09 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 222425 (current) | 2019-11-04 | cif/ Adding structures of 7234895, 7234896 via cif-deposit CGI script. |
7234895.cif |
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Users of the data should acknowledge the original authors of the
structural data.