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Information card for entry 7160545
Preview
| Coordinates | 7160545.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C39 H47 N5 O3 |
|---|---|
| Calculated formula | C39 H47 N5 O3 |
| Title of publication | Indium-Catalyzed Formal [4+1+1]/[4+1] Isocyanide-Based Annulation for Construction of Polyfunctionalized Pyrano- and Furoquinolines |
| Authors of publication | Zarei, Issa; Khosravi, Hormoz; Rominger, Frank -; Rezaei Somee, Leila; Balalaie, Saeed |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 12.7784 ± 0.0007 Å |
| b | 25.7222 ± 0.0013 Å |
| c | 12.9347 ± 0.0007 Å |
| α | 90° |
| β | 116.473 ± 0.0016° |
| γ | 90° |
| Cell volume | 3805.7 ± 0.4 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 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 | 0.1046 |
| Residual factor for significantly intense reflections | 0.0558 |
| Weighted residual factors for significantly intense reflections | 0.1223 |
| Weighted residual factors for all reflections included in the refinement | 0.1446 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299609 (current) | 2025-05-10 | cif/ Adding structures of 7160544, 7160545 via cif-deposit CGI script. |
7160545.cif |
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Users of the data should acknowledge the original authors of the
structural data.