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Information card for entry 7125414
Preview
| Coordinates | 7125414.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C33 H44 N8 O4 |
|---|---|
| Calculated formula | C33 H44 N8 O4 |
| Title of publication | A three dimensional hydrogen bonded organic framework assembled through antielectrostatic hydrogen bonds. |
| Authors of publication | Cullen, Duncan A.; Gardiner, Michael G.; White, Nicholas G. |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2019 |
| Journal volume | 55 |
| Journal issue | 80 |
| Pages of publication | 12020 - 12023 |
| a | 14.5333 ± 0.000016 Å |
| b | 14.5333 ± 0.000016 Å |
| c | 7.83602 ± 0.000013 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1655.1 ± 0.004 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 4 |
| Space group number | 86 |
| Hermann-Mauguin space group symbol | P 42/n :2 |
| Hall space group symbol | -P 4bc |
| Residual factor for all reflections | 0.0511 |
| Residual factor for significantly intense reflections | 0.0499 |
| Weighted residual factors for all reflections | 0.1348 |
| Weighted residual factors for significantly intense reflections | 0.1326 |
| Weighted residual factors for all reflections included in the refinement | 0.1348 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0161 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237861 (current) | 2019-11-24 | cif/ Adding structures of 7125414, 7125415 via cif-deposit CGI script. |
7125414.cif |
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Users of the data should acknowledge the original authors of the
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