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Information card for entry 7241676
Preview
| Coordinates | 7241676.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C11 H14 Cl N O2 |
|---|---|
| Calculated formula | C11 H14 Cl N O2 |
| SMILES | [Cl-].O.[nH+]1ccc(c2ccccc2)cc1.O |
| Title of publication | Aggregation induced emission in one easy step: pyridinium AIEgens and counter ion effect |
| Authors of publication | Leduskrasts, Kaspars; Suna, Edgars |
| Journal of publication | RSC Advances |
| Year of publication | 2020 |
| Journal volume | 10 |
| Journal issue | 62 |
| Pages of publication | 38107 - 38113 |
| a | 7.011 ± 0.0001 Å |
| b | 9.8156 ± 0.0001 Å |
| c | 17.0473 ± 0.0002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1173.15 ± 0.02 Å3 |
| Cell temperature | 160 ± 0.1 K |
| Ambient diffraction temperature | 160 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0693 |
| Residual factor for significantly intense reflections | 0.0678 |
| Weighted residual factors for significantly intense reflections | 0.199 |
| Weighted residual factors for all reflections included in the refinement | 0.2025 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.101 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 259587 (current) | 2020-12-06 | cif/ Adding structures of 7241675, 7241676, 7241677, 7241678, 7241679, 7241680 via cif-deposit CGI script. |
7241676.cif |
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Users of the data should acknowledge the original authors of the
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