Information card for entry 2222222

Structure parameters

• Chemical name: [μ-Bis(5,7-dimethyl-1,8-naphthyridin-2-yl)diazene]bis[difluoridoboron(III)]
• Formula: C20 H18 B2 F4 N6
• Calculated formula: C20 H18 B2 F4 N6
• SMILES: FB1(F)n2c(ccc3c(cc(C)nc23)C)=[N]2[B](F)(F)n3c(ccc4c(cc(C)nc34)C)=[N]12
• Title of publication: [μ-Bis(5,7-dimethyl-1,8-naphthyridin-2-yl)diazene]bis[difluoridoboron(III)]
• Authors of publication: Li, Xin-Sheng; Mo, Juan; Yuan, Li; Liu, Jian-Hua; Zhang, Su-Mei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 7
• Pages of publication: o1673
• a: 8.5379 ± 0.0017 Å
• b: 14.696 ± 0.003 Å
• c: 15.467 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1940.7 ± 0.7 ų
• Cell temperature: 272 ± 3 K
• Ambient diffraction temperature: 272 ± 3 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0613
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.1153
• Weighted residual factors for all reflections included in the refinement: 0.1273
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes