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Information card for entry 7135150
Preview
| Coordinates | 7135150.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H26 N2 O |
|---|---|
| Calculated formula | C32 H26 N2 O |
| Title of publication | Design, synthesis and structural investigation of a novel class of aggregation-induced emission (AIE) molecular scaffolds |
| Authors of publication | Ma, Qiyuan; Qin, Hao; He, Xulong; Zheng, Zexi; Ding, Yawen; Yuan, Yu; Zhang, Shuwei; Jia, Xiaodong |
| Journal of publication | Chemical Communications |
| Year of publication | 2025 |
| a | 11.6092 ± 0.0009 Å |
| b | 12.2172 ± 0.001 Å |
| c | 16.4574 ± 0.0013 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2334.2 ± 0.3 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 4 |
| 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 | 0.045 |
| Residual factor for significantly intense reflections | 0.0388 |
| Weighted residual factors for significantly intense reflections | 0.094 |
| Weighted residual factors for all reflections included in the refinement | 0.0972 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.092 |
| Diffraction radiation wavelength | 1.34139 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 303198 (current) | 2025-11-06 | cif/ Adding structures of 7135149, 7135150 via cif-deposit CGI script. |
7135150.cif |
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