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Information card for entry 1575092
Preview
| Coordinates | 1575092.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H23 N O5 |
|---|---|
| Calculated formula | C24 H23 N O5 |
| Title of publication | Copper-catalyzed direct regioselective C5–H alkylation reactions of functionalized indoles with α-diazomalonates |
| Authors of publication | Isono, Tomohiro; Harada, Shingo; Yanagawa, Mai; Nemoto, Tetsuhiro |
| Journal of publication | Chemical Science |
| Year of publication | 2025 |
| a | 8.1618 ± 0.0002 Å |
| b | 11.0202 ± 0.0003 Å |
| c | 12.1858 ± 0.0003 Å |
| α | 80.226 ± 0.006° |
| β | 71.038 ± 0.005° |
| γ | 81.929 ± 0.006° |
| Cell volume | 1017.24 ± 0.06 Å3 |
| Cell temperature | 93 ± 2 K |
| Ambient diffraction temperature | 93.15 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0563 |
| Residual factor for significantly intense reflections | 0.0429 |
| Weighted residual factors for significantly intense reflections | 0.1096 |
| Weighted residual factors for all reflections included in the refinement | 0.1165 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54187 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301260 (current) | 2025-07-16 | cif/ Adding structures of 1575092 via cif-deposit CGI script. |
1575092.cif |
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Users of the data should acknowledge the original authors of the
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