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Information card for entry 1549092
Preview
| Coordinates | 1549092.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H34 N2 O4 S |
|---|---|
| Calculated formula | C28 H34 N2 O3.995 S |
| SMILES | S(=O)(=O)(N(Cc1cc(c2[nH]c3c(c2c1C)cccc3)C)CC(OCC)OCC)c1ccc(cc1)C |
| Title of publication | Carbazole-based compounds as photoinitiators for free radical and cationic polymerization upon near visible light illumination. |
| Authors of publication | Al Mousawi, Assi; Arar, Ahmad; Ibrahim-Ouali, Malika; Duval, Sylvain; Dumur, Frédéric; Garra, Patxi; Toufaily, Joumana; Hamieh, Tayssir; Graff, Bernadette; Gigmes, Didier; Fouassier, Jean-Pierre; Lalevée, Jacques |
| 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 | 5 |
| Pages of publication | 578 - 585 |
| a | 10.0007 ± 0.001 Å |
| b | 10.5374 ± 0.0011 Å |
| c | 12.7404 ± 0.0013 Å |
| α | 102.821 ± 0.004° |
| β | 90.215 ± 0.004° |
| γ | 102.549 ± 0.004° |
| Cell volume | 1275.9 ± 0.2 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100.06 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 | 0.0687 |
| Residual factor for significantly intense reflections | 0.0519 |
| Weighted residual factors for significantly intense reflections | 0.1223 |
| Weighted residual factors for all reflections included in the refinement | 0.1328 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 230890 (current) | 2019-11-17 | cif/ Updating files of 1549092 Original log message: Adding full bibliography for 1549092.cif. |
1549092.cif |
| 207038 | 2018-03-21 | cif/ Adding structures of 1549092 via cif-deposit CGI script. |
1549092.cif |
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Users of the data should acknowledge the original authors of the
structural data.