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Information card for entry 7134591
Preview
| Coordinates | 7134591.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H20 B5 N2 O5 Zn |
|---|---|
| Calculated formula | C17 H20 B5 N2 O5 Zn |
| Title of publication | A new carborane scaffold for assembling metal–organic frameworks |
| Authors of publication | Windsor, Hunter J.; Carraro, Thomas J. C.; Walwyn, Robert J.; Rendina, Louis M.; Kepert, Cameron J. |
| Journal of publication | Chemical Communications |
| Year of publication | 2025 |
| Journal volume | 61 |
| Journal issue | 53 |
| Pages of publication | 9634 - 9637 |
| a | 18.7418 ± 0.0003 Å |
| b | 13.2211 ± 0.0003 Å |
| c | 17.2876 ± 0.0004 Å |
| α | 90° |
| β | 93.051 ± 0.002° |
| γ | 90° |
| Cell volume | 4277.57 ± 0.15 Å3 |
| Cell temperature | 180 ± 0.19 K |
| Ambient diffraction temperature | 180 ± 0.19 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0426 |
| Residual factor for significantly intense reflections | 0.0373 |
| Weighted residual factors for significantly intense reflections | 0.113 |
| Weighted residual factors for all reflections included in the refinement | 0.1175 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.057 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300427 (current) | 2025-07-06 | cif/ Updating files of 7134590, 7134591, 7134592, 7134593, 7134594, 7134595, 7134596, 7134597, 7134598, 7134599, 7134600, 7134601, 7134602, 7134603, 7134604, 7134605, 7134606, 7134607, 7134608, 7134609, 7134610, 7134611, 7134612, 7134613 Original log message: Adding full bibliography for 7134590--7134613.cif. |
7134591.cif |
| 299842 | 2025-05-29 | cif/ Adding structures of 7134590, 7134591, 7134592, 7134593, 7134594, 7134595, 7134596, 7134597, 7134598, 7134599, 7134600, 7134601, 7134602, 7134603, 7134604, 7134605, 7134606, 7134607, 7134608, 7134609, 7134610, 7134611, 7134612, 7134613 via cif-deposit CGI script. |
7134591.cif |
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Users of the data should acknowledge the original authors of the
structural data.