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Information card for entry 7063863
Preview
| Coordinates | 7063863.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C29 H27 Cu2 F6 N5 O12 S2 |
|---|---|
| Calculated formula | C29 H27 Cu2 F6 N4.5 O12 S2 |
| Title of publication | (S)-BINOL-Derived Chiral Picolinate Ligand as a platform for new polymer frameworks. A pilot study on the effect of binaphthyl scaffold vs. picolinate. |
| Authors of publication | Rodríguez Hernández, Humberto Adrián; Cruz, Daniel A.; Padrón, Juan Ignacio; Lorenzo-Luis, Pablo |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2025 |
| a | 14.5386 ± 0.0004 Å |
| b | 14.5386 ± 0.0004 Å |
| c | 38.0549 ± 0.0009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 8043.7 ± 0.4 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 88 |
| Hermann-Mauguin space group symbol | I 41/a :2 |
| Hall space group symbol | -I 4ad |
| Residual factor for all reflections | 0.1061 |
| Residual factor for significantly intense reflections | 0.0887 |
| Weighted residual factors for significantly intense reflections | 0.2628 |
| Weighted residual factors for all reflections included in the refinement | 0.28 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0827 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300240 (current) | 2025-06-27 | cif/ Adding structures of 7063861, 7063862, 7063863 via cif-deposit CGI script. |
7063863.cif |
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Users of the data should acknowledge the original authors of the
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