Information card for entry 7047161

Structure parameters

• Formula: C144 H102 F36 Ir2 N12
• Calculated formula: C144 H102 F36 Ir2 N12
• Title of publication: High efficiency green OLEDs based on homoleptic iridium complexes with steric phenylpyridazine ligands.
• Authors of publication: Tong, Bihai; Wang, Han; Chen, Man; Zhou, Shixiong; Hu, Yuanyuan; Zhang, Qianfeng; He, Gufeng; Fu, Lianshe; Shi, Huatian; Jin, Long; Zhou, Huidong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 35
• Pages of publication: 12243 - 12252
• a: 16.4832 ± 0.0005 Å
• b: 17.6037 ± 0.0005 Å
• c: 25.5185 ± 0.0007 Å
• α: 109.318 ± 0.001°
• β: 95.808 ± 0.002°
• γ: 100.477 ± 0.001°
• Cell volume: 6766.5 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0744
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.1444
• Weighted residual factors for all reflections included in the refinement: 0.1664
• Goodness-of-fit parameter for all reflections included in the refinement: 0.983
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No