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Information card for entry 7241738
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| Coordinates | 7241738.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | 4-Aminoazobenzene;1,2-bis(4-pyridyl)ethane |
|---|---|
| Formula | C24 H23 N5 |
| Calculated formula | C24 H23 N5 |
| Title of publication | Tuning the photomechanical behavior and excellent elasticity of azobenzene via cocrystal engineering |
| Authors of publication | Ye, Yang; Gao, Lei; Hao, Hongxun; Yin, Qiuxiang; Xie, Chuang |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| Journal volume | 22 |
| Journal issue | 46 |
| Pages of publication | 8045 - 8053 |
| a | 7.73 ± 0.0006 Å |
| b | 5.6677 ± 0.0004 Å |
| c | 23.0411 ± 0.0014 Å |
| α | 90° |
| β | 91.233 ± 0.006° |
| γ | 90° |
| Cell volume | 1009.23 ± 0.12 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123.15 K |
| Number of distinct elements | 3 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.1033 |
| Residual factor for significantly intense reflections | 0.0715 |
| Weighted residual factors for significantly intense reflections | 0.1964 |
| Weighted residual factors for all reflections included in the refinement | 0.2223 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301870 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/24/ Each referenced PubChem compound corresponds to the full crystal structure. |
7241738.cif |
| 259731 | 2020-12-10 | cif/ Adding structures of 7241736, 7241737, 7241738, 7241739, 7241740 via cif-deposit CGI script. |
7241738.cif |
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Users of the data should acknowledge the original authors of the
structural data.