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Information card for entry 7704223
Preview
| Coordinates | 7704223.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | (Clip)Os(py)2 |
|---|---|
| Chemical name | 2,2'-Biphenylbis((2-oxy-3,5-di-tert-butylphenyl)amido)-bis(pyridine)osmium(IV) |
| Formula | C50 H58 N4 O2 Os |
| Calculated formula | C50 H58 N4 O2 Os |
| SMILES | [Os]123(Oc4c(N1c1c(cccc1)c1c(N3c3c(O2)c(cc(c3)C(C)(C)C)C(C)(C)C)cccc1)cc(cc4C(C)(C)C)C(C)(C)C)([n]1ccccc1)[n]1ccccc1 |
| Title of publication | Highly covalent metal-ligand π bonding in chelated bis- and tris(iminoxolene) complexes of osmium and ruthenium. |
| Authors of publication | Gianino, Jacqueline; Brown, Seth N. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2020 |
| Journal volume | 49 |
| Journal issue | 21 |
| Pages of publication | 7015 - 7027 |
| a | 9.87 ± 0.007 Å |
| b | 23.816 ± 0.019 Å |
| c | 19.126 ± 0.014 Å |
| α | 90° |
| β | 90.1 ± 0.02° |
| γ | 90° |
| Cell volume | 4496 ± 6 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0721 |
| Residual factor for significantly intense reflections | 0.0606 |
| Weighted residual factors for significantly intense reflections | 0.1495 |
| Weighted residual factors for all reflections included in the refinement | 0.1544 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.219 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301878 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/70/ Each referenced PubChem compound corresponds to the full crystal structure. |
7704223.cif |
| 252835 | 2020-06-05 | cif/ Updating files of 7704222, 7704223, 7704224, 7704225 Original log message: Adding full bibliography for 7704222--7704225.cif. |
7704223.cif |
| 251297 | 2020-04-30 | cif/ Adding structures of 7704222, 7704223, 7704224, 7704225 via cif-deposit CGI script. |
7704223.cif |
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