Information card for entry 2205493

Structure parameters

• Chemical name: Chlorobis[2-(2-pyridyl)phenyl-κ^2^N,C^1^](triphenylphosphine- κP)iridium(III)‒dichloromethane (2/3)
• Formula: C41.5 H34 Cl4 Ir N2 P
• Calculated formula: C41.5 H34 Cl4 Ir N2 P
• Title of publication: Chlorobis[2-(2-pyridyl)phenyl-κ^2^<i>N,C</i>^1^](triphenylphosphine-κ<i>P</i>)iridium(III) dichloromethane sesquisolvate
• Authors of publication: Wang, Yuanmin; Teng, Feng; Tang, Aiwei; Wang, Yongsheng; Xu, Xurong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 4
• Pages of publication: m778 - m780
• a: 10.128 ± 0.002 Å
• b: 15.038 ± 0.003 Å
• c: 24.586 ± 0.005 Å
• α: 90°
• β: 99.7 ± 0.03°
• γ: 90°
• Cell volume: 3691 ± 1.3 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0752
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.1118
• Weighted residual factors for all reflections included in the refinement: 0.1198
• Goodness-of-fit parameter for all reflections included in the refinement: 0.958
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes