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Information card for entry 1572972
Preview
| Coordinates | 1572972.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H52 Cl F6 N5 O4 |
|---|---|
| Calculated formula | C40 H52 Cl F6 N5 O4 |
| Title of publication | Stimuli-responsive anion transport utilising caged hydrazone-based anionophores |
| Authors of publication | Ahmad, Manzoor; Flerin, Martin; Tay, Hui Min; Thompson, Amber L.; Duarte, Fernanda; Langton, Matthew J. |
| Journal of publication | Nanoscale |
| Year of publication | 2024 |
| a | 10.5597 ± 0.0004 Å |
| b | 10.1486 ± 0.0005 Å |
| c | 38.667 ± 0.002 Å |
| α | 90° |
| β | 92.415 ± 0.004° |
| γ | 90° |
| Cell volume | 4140.1 ± 0.3 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 6 |
| 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 | 0.1108 |
| Residual factor for significantly intense reflections | 0.0925 |
| Weighted residual factors for all reflections | 0.2351 |
| Weighted residual factors for significantly intense reflections | 0.2235 |
| Weighted residual factors for all reflections included in the refinement | 0.2351 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0307 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 295673 (current) | 2024-10-30 | cif/ Adding structures of 1572971, 1572972 via cif-deposit CGI script. |
1572972.cif |
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