Information card for entry 7236756

Structure parameters

• Common name: k161103
• Chemical name: Ir(dfCF3)2bor
• Formula: C38 H26 B F10 Ir N10
• Calculated formula: C38 H26 B F10 Ir N10
• Title of publication: Important role of ancillary ligand in the emission behaviours of blue-emitting heteroleptic Ir(iii) complexes
• Authors of publication: Cho, Yang-Jin; Kim, So-Yoen; Kim, Jin-Hyoung; Crandell, Douglas W.; Baik, Mu-Hyun; Lee, Jiwon; Kim, Chul Hoon; Son, Ho-Jin; Han, Won-Sik; Kang, Sang Ook
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2017
• Journal volume: 5
• Journal issue: 18
• Pages of publication: 4480
• a: 10.044 ± 0.004 Å
• b: 13.686 ± 0.005 Å
• c: 17.345 ± 0.007 Å
• α: 107.895 ± 0.006°
• β: 96.247 ± 0.007°
• γ: 107.337 ± 0.006°
• Cell volume: 2112.5 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0476
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.096
• Weighted residual factors for all reflections included in the refinement: 0.0994
• Goodness-of-fit parameter for all reflections included in the refinement: 0.985
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No