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Information card for entry 7234514
Preview
| Coordinates | 7234514.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H18 B N3 O |
|---|---|
| Calculated formula | C25 H18 B N3 O |
| Title of publication | Asymmetric boron-complexes containing keto-isoindolinyl and pyridyl groups: solvatochromic fluorescence, efficient solid-state emission and DFT calculations |
| Authors of publication | Yanping Wu; Hua Lu; Sisi Wang; Zhifang Li; Zhen Shen |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2015 |
| Journal volume | 3 |
| Pages of publication | 12281 - 12289 |
| a | 8.3411 ± 0.0004 Å |
| b | 9.4833 ± 0.0005 Å |
| c | 14.627 ± 0.0008 Å |
| α | 95.749 ± 0.001° |
| β | 105.792 ± 0.001° |
| γ | 113.993 ± 0.001° |
| Cell volume | 987.46 ± 0.09 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 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 | 0.0439 |
| Residual factor for significantly intense reflections | 0.0353 |
| Weighted residual factors for significantly intense reflections | 0.1018 |
| Weighted residual factors for all reflections included in the refinement | 0.1109 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 219242 (current) | 2019-10-10 | cif/ Adding structures of 7234514 via cif-deposit CGI script. |
7234514.cif |
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Users of the data should acknowledge the original authors of the
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