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Information card for entry 7123348
Preview
| Coordinates | 7123348.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | CapNFF |
|---|---|
| Formula | C20 H23 N3 O3 |
| Calculated formula | C20 H23 N3 O3 |
| Title of publication | Crystallization and Lamellar Nanosheet Formation of an Aromatic Dipeptoid |
| Authors of publication | Hamley, Ian; Chippindale, ann M; Castelletto, Valeria; Barnett, Sarah; Hasan, Abshar; Lau, Aaron |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 23.73549 ± 0.00011 Å |
| b | 16.75238 ± 0.00008 Å |
| c | 4.78477 ± 0.00002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1902.55 ± 0.015 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 33 |
| Hermann-Mauguin space group symbol | P n a 21 |
| Hall space group symbol | P 2c -2n |
| Residual factor for all reflections | 0.048 |
| Residual factor for significantly intense reflections | 0.0384 |
| Weighted residual factors for significantly intense reflections | 0.0942 |
| Weighted residual factors for all reflections included in the refinement | 0.0978 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.988 |
| Diffraction radiation wavelength | 0.6889 Å |
| Diffraction radiation type | Synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 214832 (current) | 2019-04-30 | cif/ Adding structures of 7123348 via cif-deposit CGI script. |
7123348.cif |
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Users of the data should acknowledge the original authors of the
structural data.