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Information card for entry 1555441
Preview
| Coordinates | 1555441.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H13 N O3 |
|---|---|
| Calculated formula | C18 H13 N O3 |
| SMILES | N1(C2(OC(=O)c3c2cccc3)CC(=C)C1=O)c1ccccc1 |
| Title of publication | Indium-Catalyzed Amide Allylation of N-Carbonyl Imides: Formation of Azaspiro-γ-lactones via Ring Opening-Reclosure. |
| Authors of publication | Sengoku, Tetsuya; Murata, Yusuke; Aso, Yuwa; Kawakami, Ai; Inuzuka, Toshiyasu; Sakamoto, Masami; Takahashi, Masaki; Yoda, Hidemi |
| Journal of publication | Organic letters |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 23 |
| Pages of publication | 5846 - 5849 |
| a | 9.2686 ± 0.0015 Å |
| b | 16.156 ± 0.003 Å |
| c | 9.4109 ± 0.0016 Å |
| α | 90° |
| β | 95.246 ± 0.002° |
| γ | 90° |
| Cell volume | 1403.3 ± 0.4 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 4 |
| 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 | 0.0429 |
| Residual factor for significantly intense reflections | 0.0379 |
| Weighted residual factors for significantly intense reflections | 0.0937 |
| Weighted residual factors for all reflections included in the refinement | 0.0969 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.061 |
| Diffraction radiation wavelength | 0.71073 Å |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 238680 (current) | 2019-11-24 | cif/ Adding structures of 1555441 via cif-deposit CGI script. |
1555441.cif |
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Users of the data should acknowledge the original authors of the
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