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Information card for entry 7160629
Preview
| Coordinates | 7160629.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C142 H214 F6 N16 O12 Si |
|---|---|
| Calculated formula | C142.028 H214.042 F6 N16.004 O12.004 Si |
| Title of publication | Selective Recognition and Sensing of Biologically Important Phosphates Using Triptycene-Based Anion Receptors |
| Authors of publication | Kassir, Ahmad Farouk; Lupp, Daniel; Grabowski, Jakub; Granda, Jarosław M.; Jurczak, Janusz |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 17.0525 ± 0.0008 Å |
| b | 19.664 ± 0.0009 Å |
| c | 22.12 ± 0.0011 Å |
| α | 90° |
| β | 110.679 ± 0.0015° |
| γ | 90° |
| Cell volume | 6939.4 ± 0.6 Å3 |
| Cell temperature | 103 ± 2 K |
| Ambient diffraction temperature | 103 ± 2 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 | 0.1305 |
| Residual factor for significantly intense reflections | 0.077 |
| Weighted residual factors for significantly intense reflections | 0.1938 |
| Weighted residual factors for all reflections included in the refinement | 0.2361 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300302 (current) | 2025-07-03 | cif/ Adding structures of 7160628, 7160629 via cif-deposit CGI script. |
7160629.cif |
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Users of the data should acknowledge the original authors of the
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