Information card for entry 7233115

Structure parameters

• Formula: C48 H32 B Cu F8 N4 P2
• Calculated formula: C48 H32 B Cu F8 N4 P2
• SMILES: [Cu]12([P](c3cc(F)cc(F)c3)(c3cc(F)cc(F)c3)c3ccccc3[P]1(c1cc(F)cc(F)c1)c1cc(F)cc(F)c1)[n]1n(ccc1)[B](n1[n]2ccc1)(c1ccccc1)c1ccccc1
• Title of publication: Highly efficient green organic light-emitting diodes containing luminescent tetrahedral copper(I) complexes
• Authors of publication: Satoshi Igawa; Masashi Hashimoto; Isao Kawata; Masataka Yashima; Mikio Hoshinoa; Masahisa Osawa
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2013
• Journal volume: 1
• Pages of publication: 542 - 551
• a: 12.4467 ± 0.0008 Å
• b: 13.2352 ± 0.0011 Å
• c: 13.7652 ± 0.0009 Å
• α: 89.778 ± 0.004°
• β: 70.725 ± 0.004°
• γ: 78.648 ± 0.003°
• Cell volume: 2094 ± 0.3 ų
• Cell temperature: 90 K
• Ambient diffraction temperature: 90 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0344
• Residual factor for significantly intense reflections: 0.0297
• Weighted residual factors for significantly intense reflections: 0.0802
• Weighted residual factors for all reflections included in the refinement: 0.083
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No