Information card for entry 7704636

Structure parameters

• Common name: (^H^ap)OsO(pin)
• Chemical name: Oxo(pinacolato)(2-(phenylimido)-4,6-di-tert-butylphenoxo)-osmium(VI)
• Formula: C26 H37 N O4 Os
• Calculated formula: C26 H37 N O4 Os
• SMILES: [Os]12(=O)(Oc3c(N2c2ccccc2)cc(cc3C(C)(C)C)C(C)(C)C)OC(C(O1)(C)C)(C)C
• Title of publication: High-valent osmium iminoxolene complexes.
• Authors of publication: Gianino, Jacqueline; Erickson, Alexander N.; Markovitz, Sean J.; Brown, Seth N.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 25
• Pages of publication: 8504 - 8515
• a: 10.1408 ± 0.0004 Å
• b: 16.5112 ± 0.0006 Å
• c: 15.0329 ± 0.0005 Å
• α: 90°
• β: 96.694 ± 0.001°
• γ: 90°
• Cell volume: 2499.9 ± 0.16 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0242
• Residual factor for significantly intense reflections: 0.0195
• Weighted residual factors for significantly intense reflections: 0.0422
• Weighted residual factors for all reflections included in the refinement: 0.0436
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No