Information card for entry 7200791

Structure parameters

• Common name: 4,4'-bis(pentafluorophenylethnyl)-2,2'-bipyridine
• Chemical name: 4,4'-bis(pentafluorophenylethnyl)-2,2'-bipyridine
• Formula: C26 H6 F10 N2
• Calculated formula: C26 H6 F10 N2
• SMILES: c1(cc(ccn1)C#Cc1c(F)c(F)c(F)c(F)c1F)c1cc(ccn1)C#Cc1c(F)c(F)c(F)c(F)c1F
• Title of publication: Luminescence from π‒π stacked bipyridines through arene‒perfluoroarene interactions
• Authors of publication: Hori, Akiko; Takatani, Shohei; Miyamoto, Takeshi K.; Hasegawa, Miki
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 4
• Pages of publication: 567
• a: 5.8933 ± 0.0007 Å
• b: 7.9383 ± 0.0009 Å
• c: 11.0988 ± 0.0013 Å
• α: 88.11 ± 0.001°
• β: 84.546 ± 0.001°
• γ: 89.836 ± 0.001°
• Cell volume: 516.6 ± 0.1 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0944
• Weighted residual factors for all reflections included in the refinement: 0.1004
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No