Information card for entry 7705985

Structure parameters

• Formula: C51 H46 Cl3 Ir P4
• Calculated formula: C51 H46 Cl3 Ir P4
• Title of publication: From carbones to carbenes and ylides in the coordination sphere of iridium.
• Authors of publication: Li, Yinwu; Maser, Leon; Alig, Lukas; Ke, Zhuofeng; Langer, Robert
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 3
• Pages of publication: 954 - 959
• a: 13.658 ± 0.003 Å
• b: 20.938 ± 0.004 Å
• c: 19.55 ± 0.004 Å
• α: 90°
• β: 100.38 ± 0.03°
• γ: 90°
• Cell volume: 5499 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0752
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for significantly intense reflections: 0.0989
• Weighted residual factors for all reflections included in the refinement: 0.1055
• Goodness-of-fit parameter for all reflections included in the refinement: 0.875
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No