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Information card for entry 7063772
Preview
| Coordinates | 7063772.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H16 O |
|---|---|
| Calculated formula | C27 H16 O |
| 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 | 6.229 ± 0.0007 Å |
| b | 8.9609 ± 0.0011 Å |
| c | 17.0384 ± 0.0019 Å |
| α | 103.426 ± 0.003° |
| β | 94.535 ± 0.003° |
| γ | 100.782 ± 0.003° |
| Cell volume | 901.22 ± 0.18 Å3 |
| Cell temperature | 273.15 K |
| Ambient diffraction temperature | 273.15 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 | 0.0968 |
| Residual factor for significantly intense reflections | 0.0465 |
| Weighted residual factors for significantly intense reflections | 0.1107 |
| Weighted residual factors for all reflections included in the refinement | 0.1367 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
| 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. |
7063772.cif |
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