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Information card for entry 7701968
Preview
| Coordinates | 7701968.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C29 H20 Cl Cu N3 O7 |
|---|---|
| Calculated formula | C29 H20 Cl Cu N3 O7 |
| Title of publication | Oxidative dehydrogenation of a coumarinyl scaffold with Copper ion and metal ion detection in human liver cancer cell (HepG2) |
| Authors of publication | Dey, Sunanda; Maity, Suvendu; Pal, Kunal; Jana, Kuladip; Sinha, Chittaranjan |
| Journal of publication | Dalton Transactions |
| Year of publication | 2019 |
| a | 11.7997 ± 0.0018 Å |
| b | 15.054 ± 0.002 Å |
| c | 14.475 ± 0.002 Å |
| α | 90° |
| β | 90.113 ± 0.005° |
| γ | 90° |
| Cell volume | 2571.2 ± 0.6 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.2044 |
| Residual factor for significantly intense reflections | 0.1151 |
| Weighted residual factors for significantly intense reflections | 0.2463 |
| Weighted residual factors for all reflections included in the refinement | 0.2996 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231021 (current) | 2019-11-19 | cif/ Adding structures of 7701967, 7701968 via cif-deposit CGI script. |
7701968.cif |
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Users of the data should acknowledge the original authors of the
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