Information card for entry 7234860

Structure parameters

• Formula: C56 H31 B F20 Ir N5 O2
• Calculated formula: C56 H31 B F20 Ir N5 O2
• Title of publication: Highly efficient blue-green organic light-emitting diodes achieved by controlling the anionic migration of cationic iridium(iii) complexes
• Authors of publication: Dongxin Ma; Chen Zhang; Yong Qiu; Lian Duan
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2016
• Journal volume: 4
• Pages of publication: 5731 - 5738
• a: 36.085 ± 0.007 Å
• b: 17.076 ± 0.003 Å
• c: 17.762 ± 0.004 Å
• α: 90°
• β: 110.34 ± 0.03°
• γ: 90°
• Cell volume: 10262 ± 4 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0501
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.1102
• Weighted residual factors for all reflections included in the refinement: 0.1116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.197
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No