Information card for entry 4128683

Structure parameters

• Formula: C41.75 H38 Cl Ir O P2
• Calculated formula: C41.75 H38 Cl Ir O P2
• Title of publication: Quantifying the Donor Strength of Ligand-Stabilized Main Group Fragments.
• Authors of publication: Maser, Leon; Schneider, Christian; Vondung, Lisa; Alig, Lukas; Langer, Robert
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 18
• Pages of publication: 7596 - 7604
• a: 9.6658 ± 0.0004 Å
• b: 14.2713 ± 0.0007 Å
• c: 14.767 ± 0.0007 Å
• α: 107.989 ± 0.002°
• β: 96.128 ± 0.002°
• γ: 104.806 ± 0.002°
• Cell volume: 1834.52 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 99.99 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0312
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for significantly intense reflections: 0.0662
• Weighted residual factors for all reflections included in the refinement: 0.068
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No