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Information card for entry 7245747
Preview
| Coordinates | 7245747.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C15 H25 N O2 |
|---|---|
| Calculated formula | C15 H25 N O2 |
| Title of publication | Annulated carbamates are precursors for the ring contraction of the adamantane framework |
| Authors of publication | Hrdina, Radim; Holovko-Kamoshenkova, Oksana M.; Císařová, Ivana; Koucký, Filip; Machalický, Oldřich |
| Journal of publication | RSC Advances |
| Year of publication | 2022 |
| Journal volume | 12 |
| Journal issue | 48 |
| Pages of publication | 31056 - 31060 |
| a | 12.2381 ± 0.0005 Å |
| b | 11.7529 ± 0.0006 Å |
| c | 10.0683 ± 0.0004 Å |
| α | 90° |
| β | 105.123 ± 0.003° |
| γ | 90° |
| Cell volume | 1398 ± 0.11 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0629 |
| Residual factor for significantly intense reflections | 0.0463 |
| Weighted residual factors for significantly intense reflections | 0.0994 |
| Weighted residual factors for all reflections included in the refinement | 0.109 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.057 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 278896 (current) | 2022-11-01 | cif/ Adding structures of 7245746, 7245747, 7245748 via cif-deposit CGI script. |
7245747.cif |
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Users of the data should acknowledge the original authors of the
structural data.