Information card for entry 4075830

Structure parameters

• Common name: 4,6-Dilithiodibenzofuran-1.5(tmeda)
• Formula: C42 H60 Li4 N6 O2
• Calculated formula: C42 H60 Li4 N6 O2
• Title of publication: Synthesis, Structure, and Cyclic Voltammetry of 4,6-Bis(dimesitylboryl)dibenzofuran: Isolation of 4,6-Dilithiobenzofuran and 4,5-Dilithio-9,9-dimethylxanthene as tmeda Adducts
• Authors of publication: Wang, Huadong; Gabbaï, François P.
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 12
• Pages of publication: 2898
• a: 12.644 ± 0.002 Å
• b: 14.45 ± 0.003 Å
• c: 13.141 ± 0.003 Å
• α: 90°
• β: 118.007 ± 0.003°
• γ: 90°
• Cell volume: 2119.8 ± 0.7 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.138
• Residual factor for significantly intense reflections: 0.0814
• Weighted residual factors for significantly intense reflections: 0.1611
• Weighted residual factors for all reflections included in the refinement: 0.1876
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No