Information card for entry 2243182

Structure parameters

• Chemical name: Diiodido(η^5^-pentamethylcyclopentadienyl)bis(trimethylphosphane)\ iridiumzinc(<i>Ir</i>—<i>Zn</i>) benzene hemisolvate
• Formula: C19 H36 I2 Ir P2 Zn
• Calculated formula: C19 H36 I2 Ir P2 Zn
• Title of publication: An iridium complex with an unsupported Ir—Zn bond: diiodido(η^5^-pentamethylcyclopentadienyl)bis(trimethylphosphane)iridiumzinc(<i>Ir</i>—<i>Zn</i>) benzene hemisolvate
• Authors of publication: Taullaj, Fioralba; Lough, Alan J.; Fekl, Ulrich
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2019
• Journal volume: 75
• Journal issue: 12
• Pages of publication: 1824 - 1827
• a: 9.5353 ± 0.0007 Å
• b: 10.1962 ± 0.0008 Å
• c: 14.6331 ± 0.001 Å
• α: 95.975 ± 0.002°
• β: 91.255 ± 0.002°
• γ: 114.847 ± 0.002°
• Cell volume: 1280.58 ± 0.16 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.0566
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.1071
• Weighted residual factors for all reflections included in the refinement: 0.1161
• Goodness-of-fit parameter for all reflections included in the refinement: 1.133
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes