Information card for entry 7236980

Structure parameters

• Formula: C35 H33 Cl2 F6 Ir N5 O P
• Calculated formula: C35 H33 Cl2 F6 Ir N5 O P
• Title of publication: Fluorine-free, highly efficient, blue-green and sky-blue-emitting cationic iridium complexes and their use for efficient organic light-emitting diodes
• Authors of publication: He, Lei; Lan, Ying; Ma, Dongxin; Song, Xiangzhi; Duan, Lian
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2018
• Journal volume: 6
• Journal issue: 6
• Pages of publication: 1509
• a: 8.7574 ± 0.0018 Å
• b: 12.692 ± 0.003 Å
• c: 17.8 ± 0.004 Å
• α: 74.09 ± 0.03°
• β: 79.79 ± 0.03°
• γ: 77.08 ± 0.03°
• Cell volume: 1840.2 ± 0.8 ų
• Cell temperature: 153.15 K
• Ambient diffraction temperature: 153.15 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0572
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.1439
• Weighted residual factors for all reflections included in the refinement: 0.1588
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No