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Information card for entry 7250567
Preview
| Coordinates | 7250567.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C47 H40 Au Cl N2 |
|---|---|
| Calculated formula | C47 H40 Au Cl N2 |
| Title of publication | Rational Design of Gold(I)-NHC Complexes as Anticancer Agents: Induction of Necroptosis and Paraptosis in Lung Adenocarcinoma |
| Authors of publication | Dewan, Sayari; Sonker, Himanshu; Chaudhary, Kajal; Singh, Ritika Gautam |
| Journal of publication | RSC Medicinal Chemistry |
| Year of publication | 2025 |
| a | 18.2277 ± 0.0005 Å |
| b | 19.709 ± 0.0005 Å |
| c | 20.7662 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 7460.3 ± 0.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0387 |
| Residual factor for significantly intense reflections | 0.025 |
| Weighted residual factors for significantly intense reflections | 0.048 |
| Weighted residual factors for all reflections included in the refinement | 0.0517 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300141 (current) | 2025-06-20 | cif/ Adding structures of 7250566, 7250567, 7250568, 7250569 via cif-deposit CGI script. |
7250567.cif |
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Users of the data should acknowledge the original authors of the
structural data.