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Information card for entry 7134725
Preview
| Coordinates | 7134725.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H26 O3 |
|---|---|
| Calculated formula | C21 H26 O3 |
| Title of publication | Asymmetric total syntheses of immunosuppressive diterpenoids triptobenzenes N and R via a remote Csp3-H functionalization |
| Authors of publication | Roy, Nanda Kishore; Murmu, Ranjit; Munda, Mintu; Niyogi, Sovan; Bisai, Alakesh |
| Journal of publication | Chemical Communications |
| Year of publication | 2025 |
| a | 8.3186 ± 0.0008 Å |
| b | 10.0507 ± 0.0008 Å |
| c | 10.7125 ± 0.0011 Å |
| α | 90° |
| β | 99.133 ± 0.003° |
| γ | 90° |
| Cell volume | 884.29 ± 0.14 Å3 |
| Cell temperature | 293.15 K |
| Ambient diffraction temperature | 293.15 K |
| Number of distinct elements | 3 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0251 |
| Residual factor for significantly intense reflections | 0.025 |
| Weighted residual factors for significantly intense reflections | 0.0671 |
| Weighted residual factors for all reflections included in the refinement | 0.0672 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.1118 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300103 (current) | 2025-06-18 | cif/ Adding structures of 7134724, 7134725 via cif-deposit CGI script. |
7134725.cif |
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