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Information card for entry 7251053
Preview
| Coordinates | 7251053.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H29 Cl F I N3 O2 |
|---|---|
| Calculated formula | C26 H29 Cl F I N3 O2 |
| Title of publication | Design, synthesis and structure-activity relationship analysis of the dibenzodiazepinone derivatives against osimertinib resistant NSCLC |
| Authors of publication | Jin, Chengliu; Zhang, Zhen; Liao, Peng; Zhang, Chen; Cao, Hua; Ma, Yanlong |
| Journal of publication | RSC Medicinal Chemistry |
| Year of publication | 2025 |
| a | 37.035 ± 0.003 Å |
| b | 9.0602 ± 0.0006 Å |
| c | 15.608 ± 0.0011 Å |
| α | 90° |
| β | 94.353 ± 0.003° |
| γ | 90° |
| Cell volume | 5222.1 ± 0.7 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 K |
| Number of distinct elements | 7 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0782 |
| Residual factor for significantly intense reflections | 0.0526 |
| Weighted residual factors for significantly intense reflections | 0.1133 |
| Weighted residual factors for all reflections included in the refinement | 0.1267 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.086 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 302944 (current) | 2025-10-17 | cif/ Adding structures of 7251053 via cif-deposit CGI script. |
7251053.cif |
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Users of the data should acknowledge the original authors of the
structural data.