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Information card for entry 7134834
Preview
| Coordinates | 7134834.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H16 B2 F4 N4 |
|---|---|
| Calculated formula | C26 H16 B2 F4 N4 |
| Title of publication | Dimeric Boron Complexes Bearing Isoquinolyl-pyrrole Ligands |
| Authors of publication | Nakano, Takeo; Yamada, Haruki; Inaba, Ryoto; Hamasaki, Atom; Takeda, Takashi; Ohta, Akira |
| Journal of publication | Chemical Communications |
| Year of publication | 2025 |
| a | 8.1088 ± 0.0001 Å |
| b | 14.0314 ± 0.0002 Å |
| c | 36.966 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4205.91 ± 0.11 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0559 |
| Residual factor for significantly intense reflections | 0.0439 |
| Weighted residual factors for significantly intense reflections | 0.0984 |
| Weighted residual factors for all reflections included in the refinement | 0.1038 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.075 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301259 (current) | 2025-07-16 | cif/ Adding structures of 7134834 via cif-deposit CGI script. |
7134834.cif |
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Users of the data should acknowledge the original authors of the
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