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Information card for entry 7247830
Preview
| Coordinates | 7247830.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C33 H36 N2 O4 |
|---|---|
| Calculated formula | C33 H36 N2 O4 |
| Title of publication | Discovery of phenolic 2-arylidene-isoquinolinones with antioxidant and α-glucosidase inhibition dual action. |
| Authors of publication | Hernández-Vázquez, Eduardo; Martínez-Caballero, Siseth; Aldana-Torres, Diana; Estrada-Soto, Samuel; Nieto-Camacho, Antonio |
| Journal of publication | RSC Medicinal Chemistry |
| Year of publication | 2023 |
| a | 9.0933 ± 0.0012 Å |
| b | 16.561 ± 0.003 Å |
| c | 19.628 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2955.9 ± 0.9 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0596 |
| Residual factor for significantly intense reflections | 0.0527 |
| Weighted residual factors for significantly intense reflections | 0.1418 |
| Weighted residual factors for all reflections included in the refinement | 0.1505 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.073 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288027 (current) | 2023-12-05 | cif/ Adding structures of 7247830 via cif-deposit CGI script. |
7247830.cif |
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Users of the data should acknowledge the original authors of the
structural data.