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Information card for entry 1577441
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| Coordinates | Coordinates are not available: file is not found. |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C6 H28 B21 K |
|---|---|
| Calculated formula | C6 H28 B21 K |
| Title of publication | Bis(Carboranyl)boryl Anions |
| Authors of publication | Vashisth, Kanika; Thornton, Ragene; Yoon, Bohak; Martin, Caleb Daniel |
| Journal of publication | Chemical Science |
| Year of publication | 2026 |
| a | 13.5854 ± 0.0012 Å |
| b | 13.7659 ± 0.0015 Å |
| c | 22.604 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4227.3 ± 0.7 Å3 |
| Cell temperature | 423 ± 2 K |
| Ambient diffraction temperature | 423.15 K |
| Number of distinct elements | 4 |
| 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 | 0.0617 |
| Residual factor for significantly intense reflections | 0.0497 |
| Weighted residual factors for significantly intense reflections | 0.1471 |
| Weighted residual factors for all reflections included in the refinement | 0.1633 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0479 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 306651 (current) | 2026-06-26 | cif/ Adding structures of 1577437, 1577438, 1577439, 1577440, 1577441 via cif-deposit CGI script. |
1577441.cif |
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