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Information card for entry 7233955
Preview
| Coordinates | 7233955.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | 4,4'-(2,2-bis(4-fluorophenyl)ethene-1,1-diyl)bis(N,N-diethylaniline) |
|---|---|
| Formula | C34 H36 F2 N2 |
| Calculated formula | C34 H36 F2 N2 |
| SMILES | Fc1ccc(C(=C(c2ccc(N(CC)CC)cc2)c2ccc(N(CC)CC)cc2)c2ccc(F)cc2)cc1 |
| Title of publication | Diethylamino functionalized tetraphenylethenes: structural and electronic modulation of photophysical properties, implication for the CIE mechanism and application to cell imaging |
| Authors of publication | Yiliu Lin; Gan Chen; Lifang Zhao; Wang Zhang Yuan; Yongming Zhang; Ben Zhong Tang |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2015 |
| Journal volume | 3 |
| Pages of publication | 112 - 120 |
| a | 9.6825 ± 0.0004 Å |
| b | 10.7418 ± 0.0005 Å |
| c | 14.3568 ± 0.0007 Å |
| α | 73.476 ± 0.004° |
| β | 76.694 ± 0.004° |
| γ | 88.074 ± 0.004° |
| Cell volume | 1392.3 ± 0.12 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.047 |
| Residual factor for significantly intense reflections | 0.0403 |
| Weighted residual factors for significantly intense reflections | 0.116 |
| Weighted residual factors for all reflections included in the refinement | 0.1196 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| 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. |
7233955.cif |
| 218538 | 2019-09-19 | cif/ Adding structures of 7233955 via cif-deposit CGI script. |
7233955.cif |
All data in the COD and the database itself are dedicated to the
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.
Users of the data should acknowledge the original authors of the
structural data.