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Information card for entry 7125690
Preview
| Coordinates | 7125690.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C28 H24 N3 O2 P |
|---|---|
| Calculated formula | C28 H24 N3 O2 P |
| Title of publication | Cobaltaelectro-catalyzed oxidative allene annulation by electro-removable hydrazides. |
| Authors of publication | Mei, Ruhuai; Fang, Xinyue; He, Liang; Sun, Junmei; Zou, Liang; Ma, Wenbo; Ackermann, Lutz |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2020 |
| Journal volume | 56 |
| Journal issue | 9 |
| Pages of publication | 1393 - 1396 |
| a | 9.7656 ± 0.0003 Å |
| b | 22.5128 ± 0.0005 Å |
| c | 11.5704 ± 0.0003 Å |
| α | 90° |
| β | 110.736 ± 0.003° |
| γ | 90° |
| Cell volume | 2378.98 ± 0.12 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.071 |
| Residual factor for significantly intense reflections | 0.0618 |
| Weighted residual factors for significantly intense reflections | 0.1683 |
| Weighted residual factors for all reflections included in the refinement | 0.1834 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301860 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/12/ Each referenced PubChem compound corresponds to the full crystal structure. |
7125690.cif |
| 247619 | 2020-02-04 | cif/ Updating files of 7125690, 7125691 Original log message: Adding full bibliography for 7125690--7125691.cif. |
7125690.cif |
| 245548 | 2019-12-24 | cif/ Adding structures of 7125690, 7125691 via cif-deposit CGI script. |
7125690.cif |
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Users of the data should acknowledge the original authors of the
structural data.