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Information card for entry 7063773
Preview
| Coordinates | 7063773.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C54 H30 O2 |
|---|---|
| Calculated formula | C54 H30 O2 |
| Title of publication | Dual space-conjugated pyrene-based ketone exhibits the dual state-tuned emission wavelengths and enhanced circularly polarized luminescence |
| Authors of publication | Ji, Yao; Meng, Xin; Han, Jia'ao; Liu, Yanchen; Tang, Jian; He, Yuan-Chun; Zhang, Ensheng; Zhang, Xiaoxiang; Cao, Ziping |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2025 |
| a | 8.1952 ± 0.0009 Å |
| b | 8.1952 ± 0.0009 Å |
| c | 52.758 ± 0.008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3543.3 ± 0.8 Å3 |
| Cell temperature | 273.15 K |
| Ambient diffraction temperature | 273.15 K |
| Number of distinct elements | 3 |
| Space group number | 92 |
| Hermann-Mauguin space group symbol | P 41 21 2 |
| Hall space group symbol | P 4abw 2nw |
| Residual factor for all reflections | 0.0793 |
| Residual factor for significantly intense reflections | 0.0537 |
| Weighted residual factors for significantly intense reflections | 0.1328 |
| Weighted residual factors for all reflections included in the refinement | 0.147 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.063 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299342 (current) | 2025-04-22 | cif/ Adding structures of 7063772, 7063773 via cif-deposit CGI script. |
7063773.cif |
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