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Information card for entry 2023505
Preview
| Coordinates | 2023505.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C15 H13 N O2 |
|---|---|
| Calculated formula | C15 H13 N O2 |
| Title of publication | Synthesis, crystal structure and Hirshfeld surface analysis of Fmoc-β-amino butyric acid and Fmoc carbamate |
| Authors of publication | Abubakar Magaji, Mubarak; Chen, Beining; Robertson, Craig Collumbine |
| Journal of publication | Acta Crystallographica Section E Crystallographic Communications |
| Year of publication | 2025 |
| Journal volume | 81 |
| Journal issue | 6 |
| a | 15.356 ± 0.0003 Å |
| b | 5.04 ± 0.0001 Å |
| c | 31.0254 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2401.19 ± 0.09 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 4 |
| Space group number | 29 |
| Hermann-Mauguin space group symbol | P c a 21 |
| Hall space group symbol | P 2c -2ac |
| Residual factor for all reflections | 0.0345 |
| Residual factor for significantly intense reflections | 0.0295 |
| Weighted residual factors for significantly intense reflections | 0.0647 |
| Weighted residual factors for all reflections included in the refinement | 0.0678 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299653 (current) | 2025-05-14 | cif/ Adding structures of 2023504, 2023505 via cif-deposit CGI script. |
2023505.cif |
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