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Information card for entry 7135285
Preview
| Coordinates | 7135285.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H36 N4 O6 |
|---|---|
| Calculated formula | C34 H36 N4 O6 |
| Title of publication | Ru-Catalyzed C-H Annulation: Accessing Quinazolinone-BCP Hybrids from Stable Precursors |
| Authors of publication | Luan, Yu-Yong; Li, Jin-Ye; Liu, Xue-Yuan; Liang, Yong-Min |
| Journal of publication | Chemical Communications |
| Year of publication | 2026 |
| a | 9.0582 ± 0.0001 Å |
| b | 11.4917 ± 0.0002 Å |
| c | 16.1874 ± 0.0002 Å |
| α | 102.344 ± 0.001° |
| β | 104.774 ± 0.001° |
| γ | 102.029 ± 0.001° |
| Cell volume | 1528.74 ± 0.04 Å3 |
| Cell temperature | 295.52 ± 0.1 K |
| Ambient diffraction temperature | 295.52 ± 0.1 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 | 0.0512 |
| Residual factor for significantly intense reflections | 0.0469 |
| Weighted residual factors for significantly intense reflections | 0.1376 |
| Weighted residual factors for all reflections included in the refinement | 0.1414 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.072 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 304016 (current) | 2025-12-04 | cif/ Adding structures of 7135285 via cif-deposit CGI script. |
7135285.cif |
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Users of the data should acknowledge the original authors of the
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