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Information card for entry 4518731
Preview
| Coordinates | 4518731.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H20 O3 |
|---|---|
| Calculated formula | C26 H20 O3 |
| Title of publication | Gold-Catalyzed [5,5]-Rearrangement |
| Authors of publication | Hu, Chao; Farshadfar, Kaveh; Dietl, Martin C.; Cervantes-Reyes, Alejandro; Wang, Tao; Adak, Tapas; Rudolph, Matthias; Rominger, Frank; Li, Jun; Ariafard, Alireza; Hashmi, A. Stephen K. |
| Journal of publication | ACS Catalysis |
| Year of publication | 2021 |
| Pages of publication | 6510 - 6518 |
| a | 19.1548 ± 0.0006 Å |
| b | 14.4591 ± 0.0004 Å |
| c | 21.2542 ± 0.0006 Å |
| α | 90° |
| β | 104.153 ± 0.002° |
| γ | 90° |
| Cell volume | 5707.9 ± 0.3 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1329 |
| Residual factor for significantly intense reflections | 0.0616 |
| Weighted residual factors for significantly intense reflections | 0.157 |
| Weighted residual factors for all reflections included in the refinement | 0.1995 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.998 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 265330 (current) | 2021-05-20 | cif/ Adding structures of 4518731 via cif-deposit CGI script. |
4518731.cif |
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