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Information card for entry 7054925
Preview
| Coordinates | 7054925.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C25 H23 N |
|---|---|
| Calculated formula | C25 H23 N |
| Title of publication | Molecular amorphous glasses toward large azomethine crystals with aggregation-induced emission |
| Authors of publication | Marin, Luminita; van der Lee, Arie; Shova, Sergiu; Arvinte, Adina; Barboiu, Mihail |
| Journal of publication | New J. Chem. |
| Year of publication | 2015 |
| Journal volume | 39 |
| Journal issue | 8 |
| Pages of publication | 6404 |
| a | 8.2148 ± 0.0003 Å |
| b | 9.5771 ± 0.0003 Å |
| c | 12.8008 ± 0.0005 Å |
| α | 73.643 ± 0.003° |
| β | 73.317 ± 0.003° |
| γ | 89.653 ± 0.003° |
| Cell volume | 922.58 ± 0.06 Å3 |
| Cell temperature | 175 K |
| Ambient diffraction temperature | 175 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0941 |
| Residual factor for significantly intense reflections | 0.063 |
| Weighted residual factors for all reflections | 0.0737 |
| Weighted residual factors for significantly intense reflections | 0.0682 |
| Weighted residual factors for all reflections included in the refinement | 0.0682 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0521 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301851 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/05/ Each referenced PubChem compound corresponds to the full crystal structure. |
7054925.cif |
| 176428 | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
7054925.cif |
| 153256 | 2015-08-08 | cif/ Updating files of 7054919, 7054920, 7054921, 7054922, 7054923, 7054924, 7054925, 7054926, 7054927, 7054928 Original log message: Adding full bibliography for 7054919--7054928.cif. |
7054925.cif |
| 139068 | 2015-06-11 | cif/ Adding structures of 7054919, 7054920, 7054921, 7054922, 7054923, 7054924, 7054925, 7054926, 7054927, 7054928 via cif-deposit CGI script. |
7054925.cif |
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Users of the data should acknowledge the original authors of the
structural data.