Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7132148
Preview
| Coordinates | 7132148.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H22 N2 O2 |
|---|---|
| Calculated formula | C27 H22 N2 O2 |
| Title of publication | Ag(I)-Catalyzed Dearomatizing Spirocyclization/Nucleophile Addition Cascade Reactions of Indole-tethered Ynones |
| Authors of publication | Bag, Debojyoti; Sawant, Sanghapal D. |
| Journal of publication | Chemical Communications |
| Year of publication | 2023 |
| a | 15.1135 ± 0.0006 Å |
| b | 10.4102 ± 0.0004 Å |
| c | 15.422 ± 0.0005 Å |
| α | 90° |
| β | 119.015 ± 0.001° |
| γ | 90° |
| Cell volume | 2121.88 ± 0.14 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 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 | 0.0615 |
| Residual factor for significantly intense reflections | 0.0499 |
| Weighted residual factors for significantly intense reflections | 0.1208 |
| Weighted residual factors for all reflections included in the refinement | 0.1278 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 286470 (current) | 2023-09-23 | cif/ Adding structures of 7132148, 7132149 via cif-deposit CGI script. |
7132148.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.