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Information card for entry 7059127
Preview
| Coordinates | 7059127.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C27 H25 Cl N2 O2 |
|---|---|
| Calculated formula | C27 H25 Cl N2 O2 |
| Title of publication | Facile one-pot synthesis of spirooxindole-pyrrolidine derivatives and their antimicrobial and acetylcholinesterase inhibitory activities |
| Authors of publication | Huang, Ying; Min, Wei; Wu, Qiu-Wen; Sun, Jing; Shi, Da-Hua; Yan, Chao-Guo |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2018 |
| Journal volume | 42 |
| Journal issue | 19 |
| Pages of publication | 16211 |
| a | 9.624 ± 0.003 Å |
| b | 10.925 ± 0.003 Å |
| c | 11.808 ± 0.003 Å |
| α | 85.813 ± 0.008° |
| β | 81.37 ± 0.009° |
| γ | 71.045 ± 0.008° |
| Cell volume | 1160.5 ± 0.6 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.136 |
| Residual factor for significantly intense reflections | 0.0677 |
| Weighted residual factors for significantly intense reflections | 0.1796 |
| Weighted residual factors for all reflections included in the refinement | 0.2064 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.07 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301851 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/05/ Each referenced PubChem compound corresponds to the full crystal structure. |
7059127.cif |
| 236875 | 2019-11-24 | cif/ Adding structures of 7059123, 7059124, 7059125, 7059126, 7059127, 7059128, 7059129, 7059130, 7059131 via cif-deposit CGI script. |
7059127.cif |
All data in the COD and the database itself are dedicated to the
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.
Users of the data should acknowledge the original authors of the
structural data.