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Information card for entry 1571122
Preview
| Coordinates | 1571122.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | DMI-57 |
|---|---|
| Formula | C14 H10 O2 Se |
| Calculated formula | C14 H10 O2 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 | 12.249 ± 0.0004 Å |
| b | 7.5386 ± 0.0003 Å |
| c | 12.9332 ± 0.0005 Å |
| α | 90° |
| β | 102.563 ± 0.001° |
| γ | 90° |
| Cell volume | 1165.66 ± 0.08 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.0379 |
| Residual factor for significantly intense reflections | 0.0286 |
| Weighted residual factors for significantly intense reflections | 0.0663 |
| Weighted residual factors for all reflections included in the refinement | 0.0709 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 290304 (current) | 2024-03-05 | cif/ Adding structures of 1571122 via cif-deposit CGI script. |
1571122.cif |
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