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Information card for entry 7160679
Preview
| Coordinates | 7160679.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C47 H41 Cl3 N4 |
|---|---|
| Calculated formula | C46.995 H40.995 Cl2.985 N4 |
| Title of publication | Synthesis and properties of tetra-aryl azobispyrroles |
| Authors of publication | Sequeira, Steve O.; Diaz-Rodriguez, Roberto M.; Atansi, Mmasinachi; Hilborn, James W.; Alkaş, Adil; Gapare, Rosinah Liandrah; Dearden, Madeleine; Sullivan, Em C.; Brown, Emily B.; Robertson, Katherine N.; Thompson, Alison |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 11.3441 ± 0.0008 Å |
| b | 12.4064 ± 0.0009 Å |
| c | 14.9314 ± 0.0011 Å |
| α | 90.66 ± 0.003° |
| β | 90.394 ± 0.003° |
| γ | 112.63 ± 0.003° |
| Cell volume | 1939.4 ± 0.2 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.0829 |
| Residual factor for significantly intense reflections | 0.0635 |
| Weighted residual factors for significantly intense reflections | 0.1872 |
| Weighted residual factors for all reflections included in the refinement | 0.2113 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301747 (current) | 2025-08-15 | cif/ Adding structures of 7160678, 7160679, 7160680, 7160681 via cif-deposit CGI script. |
7160679.cif |
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Users of the data should acknowledge the original authors of the
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