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Information card for entry 1571123
Preview
| Coordinates | 1571123.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H20 N2 O4 Se |
|---|---|
| Calculated formula | C32 H20 N2 O4 Se |
| Title of publication | Metal Complexes Containing Homoleptic Diorganoselenium(II) Ligands: Synthesis, Characterization and Investigation of Optical Properties. |
| Authors of publication | Dumitraș, Darius; Gal, Emese; Silvestru, Cristian; Pop, Alexandra |
| Journal of publication | Molecules (Basel, Switzerland) |
| Year of publication | 2024 |
| Journal volume | 29 |
| Journal issue | 4 |
| Pages of publication | 792 |
| a | 13.7518 ± 0.0006 Å |
| b | 19.5095 ± 0.001 Å |
| c | 4.7253 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1267.75 ± 0.12 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 18 |
| Hermann-Mauguin space group symbol | P 21 21 2 |
| Hall space group symbol | P 2 2ab |
| Residual factor for all reflections | 0.0451 |
| Residual factor for significantly intense reflections | 0.0325 |
| Weighted residual factors for significantly intense reflections | 0.0558 |
| Weighted residual factors for all reflections included in the refinement | 0.0598 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 290305 (current) | 2024-03-05 | cif/ Adding structures of 1571123 via cif-deposit CGI script. |
1571123.cif |
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