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Information card for entry 4038846
Preview
| Coordinates | 4038846.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H16 Cl N O3 |
|---|---|
| Calculated formula | C18 H16 Cl N O3 |
| Title of publication | Silver(I)-catalyzed Domino Cyclization/Cyclopropanation/Ring-Cleavage/Nucleophilic Substitution Reaction of Enynones with Enamines: Synthesis of 4-(furan-2-yl)-3,4-dihydro-2<i>H</i>-pyrrol-2-one. |
| Authors of publication | Peng, Haiyun; Zhang, Yu; Zhu, Yang; Deng, Guisheng |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2020 |
| a | 10.01784 ± 0.00017 Å |
| b | 10.98794 ± 0.00013 Å |
| c | 15.5845 ± 0.0002 Å |
| α | 90° |
| β | 105.645 ± 0.0016° |
| γ | 90° |
| Cell volume | 1651.92 ± 0.04 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/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0405 |
| Residual factor for significantly intense reflections | 0.0379 |
| Weighted residual factors for significantly intense reflections | 0.0968 |
| Weighted residual factors for all reflections included in the refinement | 0.0988 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 256836 (current) | 2020-09-30 | cif/ Adding structures of 4038846 via cif-deposit CGI script. |
4038846.cif |
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Users of the data should acknowledge the original authors of the
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