Information card for entry 7701034

Structure parameters

• Formula: C26 H29 Cl Ir O2 P Si2
• Calculated formula: C26 H29 Cl Ir O2 P Si2
• Title of publication: Iridium complexes featuring a tridentate SiPSi ligand: from dimeric to monomeric 14, 16 or 18-electron species.
• Authors of publication: Cuevas-Chávez, Cynthia A; Vendier, Laure; Sabo-Etienne, Sylviane; Montiel-Palma, Virginia
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 37
• Pages of publication: 14010 - 14018
• a: 9.7364 ± 0.0012 Å
• b: 9.9162 ± 0.0014 Å
• c: 14.706 ± 0.002 Å
• α: 82.877 ± 0.005°
• β: 72.789 ± 0.004°
• γ: 77.865 ± 0.004°
• Cell volume: 1323 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.0306
• Residual factor for significantly intense reflections: 0.0259
• Weighted residual factors for all reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.028
• Weighted residual factors for all reflections included in the refinement: 0.0277
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No