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Information card for entry 1568059
Preview
| Coordinates | 1568059.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C52 H49 N4 O4 |
|---|---|
| Calculated formula | C52 H49 N4 O4 |
| Title of publication | Diazazethrene bisimide: a strongly electron-accepting π-system synthesized <i>via</i> the incorporation of both imide substituents and imine-type nitrogen atoms into zethrene. |
| Authors of publication | Tajima, Keita; Matsuo, Kyohei; Yamada, Hiroko; Fukui, Norihito; Shinokubo, Hiroshi |
| Journal of publication | Chemical science |
| Year of publication | 2023 |
| Journal volume | 14 |
| Journal issue | 3 |
| Pages of publication | 635 - 642 |
| a | 34.9018 ± 0.0013 Å |
| b | 59.974 ± 0.003 Å |
| c | 7.6088 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 15926.7 ± 1.2 Å3 |
| Cell temperature | 93 ± 2 K |
| Ambient diffraction temperature | 93 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 43 |
| Hermann-Mauguin space group symbol | F d d 2 |
| Hall space group symbol | F 2 -2d |
| Residual factor for all reflections | 0.1163 |
| Residual factor for significantly intense reflections | 0.0706 |
| Weighted residual factors for significantly intense reflections | 0.1505 |
| Weighted residual factors for all reflections included in the refinement | 0.1863 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 281394 (current) | 2023-03-04 | cif/ Updating files of 1568056, 1568057, 1568058, 1568059 Original log message: Adding full bibliography for 1568056--1568059.cif. |
1568059.cif |
| 279743 | 2022-12-07 | cif/ Adding structures of 1568056, 1568057, 1568058, 1568059 via cif-deposit CGI script. |
1568059.cif |
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Users of the data should acknowledge the original authors of the
structural data.