Information card for entry 7704223

Structure parameters

• 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 ų
• 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