Information card for entry 7718296

Structure parameters

• Common name: (Briq)2IrCl2 . CH3OH
• Chemical name: Bis(N-(2,6-dibromo)-4,6-di-tert-butyl-iminoxolene)dichloroiridium methanol solvate
• Formula: C41 H50 Br4 Cl2 Ir N2 O3
• Calculated formula: C41 H50 Br4 Cl2 Ir N2 O3
• Title of publication: Bis(iminoxolene)iridium complexes over four oxidation states: from sodium-iridium bonding to ligand-centered radicals.
• Authors of publication: Nugraha, Kahargyan; Do, Thomas H.; Brown, Seth N.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 14
• Pages of publication: 5896 - 5905
• a: 10.2904 ± 0.0014 Å
• b: 11.1541 ± 0.0015 Å
• c: 11.6974 ± 0.0016 Å
• α: 65.495 ± 0.002°
• β: 67.09 ± 0.002°
• γ: 80.666 ± 0.002°
• Cell volume: 1125.3 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.018
• Residual factor for significantly intense reflections: 0.0167
• Weighted residual factors for significantly intense reflections: 0.0407
• Weighted residual factors for all reflections included in the refinement: 0.0414
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No