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Information card for entry 4127247
Preview
| Coordinates | 4127247.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C16 H16 N2 O2 |
|---|---|
| Calculated formula | C16 H16 N2 O2 |
| SMILES | O(C(=O)C(=N\Nc1ccccc1)/c1ccccc1)CC |
| Title of publication | Structure Property Analysis of the Solution and Solid-State Properties of Bistable Photochromic Hydrazones. |
| Authors of publication | Shao, Baihao; Qian, Hai; Li, Quan; Aprahamian, Ivan |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2019 |
| Journal volume | 141 |
| Journal issue | 20 |
| Pages of publication | 8364 - 8371 |
| a | 21.686 ± 0.005 Å |
| b | 17.836 ± 0.004 Å |
| c | 7.2977 ± 0.0018 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2822.7 ± 1.1 Å3 |
| Number of distinct elements | 4 |
| Space group number | 41 |
| Hermann-Mauguin space group symbol | A e a 2 |
| Hall space group symbol | A 2 -2ab |
| Residual factor for all reflections | 0.047 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301834 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/12/ Each referenced PubChem compound corresponds to the full crystal structure. |
4127247.cif |
| 223192 | 2019-11-04 | cif/ Updating files of 4127241, 4127242, 4127243, 4127244, 4127245, 4127246, 4127247 Original log message: Adding full bibliography for 4127241--4127247.cif. |
4127247.cif |
| 215094 | 2019-05-13 | cif/ Adding structures of 4127247 via cif-deposit CGI script. |
4127247.cif |
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