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Information card for entry 7058717
Preview
| Coordinates | 7058717.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C40 H40 O8 |
|---|---|
| Calculated formula | C40 H40 O8 |
| Title of publication | Dual-colored 4,4′,4′′,4′′′-(cyclobutane-1,2,3,4-tetrayl)-tetrabenzoate electrochromic materials with large optical contrast and coloration efficiency |
| Authors of publication | Zhu, Chun-rong; Xie, Jia-ping; Mou, Hong-rong; Huang, Zhen-jie; Tang, Qian; Gong, Cheng-bin; Fu, Xiang-kai |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2019 |
| Journal volume | 43 |
| Journal issue | 34 |
| Pages of publication | 13654 |
| a | 7.7762 ± 0.0002 Å |
| b | 8.2847 ± 0.0004 Å |
| c | 13.7706 ± 0.0006 Å |
| α | 99.715 ± 0.004° |
| β | 94.914 ± 0.003° |
| γ | 94.61 ± 0.003° |
| Cell volume | 867.14 ± 0.06 Å3 |
| Cell temperature | 292 ± 0.2 K |
| Ambient diffraction temperature | 292 ± 0.2 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 | 0.0621 |
| Residual factor for significantly intense reflections | 0.058 |
| Weighted residual factors for significantly intense reflections | 0.1631 |
| Weighted residual factors for all reflections included in the refinement | 0.1684 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301851 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/05/ Each referenced PubChem compound corresponds to the full crystal structure. |
7058717.cif |
| 224972 | 2019-11-08 | cif/ Updating files of 7058717 Original log message: Adding full bibliography for 7058717.cif. |
7058717.cif |
| 217376 | 2019-08-03 | cif/ Adding structures of 7058717 via cif-deposit CGI script. |
7058717.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.