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Information card for entry 1577439
Preview
| Coordinates | 1577439.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C55 H90 B42 Cu2 P2 |
|---|---|
| Calculated formula | C55 H90 B42 Cu2 P2 |
| 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 | 11.313 ± 0.0001 Å |
| b | 13.3497 ± 0.0002 Å |
| c | 24.8346 ± 0.0003 Å |
| α | 90° |
| β | 90.864 ± 0.001° |
| γ | 90° |
| Cell volume | 3750.22 ± 0.08 Å3 |
| Cell temperature | 150 ± 0.1 K |
| Ambient diffraction temperature | 150 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0584 |
| Residual factor for significantly intense reflections | 0.0495 |
| Weighted residual factors for significantly intense reflections | 0.1411 |
| Weighted residual factors for all reflections included in the refinement | 0.1512 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0259 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 306651 (current) | 2026-06-25 | cif/ Adding structures of 1577437, 1577438, 1577439, 1577440, 1577441 via cif-deposit CGI script. |
1577439.cif |
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Users of the data should acknowledge the original authors of the
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