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Information card for entry 7230746
Preview
| Coordinates | 7230746.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C42 H30 |
|---|---|
| Calculated formula | C42 H30 |
| Title of publication | Synthesis, aggregation induced emission and through space conjugation of triphenylvinylphenyl substituted [2.2]paracyclophane-1,9-diene |
| Authors of publication | Yu, Chin-Yang; Lai, Yu-Chun |
| Journal of publication | RSC Advances |
| Year of publication | 2018 |
| Journal volume | 8 |
| Journal issue | 35 |
| Pages of publication | 19341 |
| a | 9.6495 ± 0.0009 Å |
| b | 25.376 ± 0.002 Å |
| c | 14.0175 ± 0.0013 Å |
| α | 90° |
| β | 107.672 ± 0.003° |
| γ | 90° |
| Cell volume | 3270.4 ± 0.5 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 2 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1113 |
| Residual factor for significantly intense reflections | 0.0978 |
| Weighted residual factors for significantly intense reflections | 0.3319 |
| Weighted residual factors for all reflections included in the refinement | 0.3573 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.603 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7230746.cif |
| 207984 | 2018-05-25 | cif/ Adding structures of 7230746, 7230747 via cif-deposit CGI script. |
7230746.cif |
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Users of the data should acknowledge the original authors of the
structural data.