Information card for entry 7112941

Structure parameters

• Formula: C28 H24 B Cu F4 N8
• Calculated formula: C28 H24 B Cu F4 N8
• Title of publication: Click-triazole: coordination of 2-(1,2,3-triazol-4-yl)-pyridine to cations of traditional tetrahedral geometry (Cu(I), Ag(I)).
• Authors of publication: Fleischel, Olivier; Wu, Nan; Petitjean, Anne
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 44
• Pages of publication: 8454 - 8456
• a: 13.2589 ± 0.0006 Å
• b: 11.2087 ± 0.0005 Å
• c: 19.7397 ± 0.0008 Å
• α: 90°
• β: 108.96 ± 0.002°
• γ: 90°
• Cell volume: 2774.5 ± 0.2 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1022
• Residual factor for significantly intense reflections: 0.0587
• Weighted residual factors for significantly intense reflections: 0.1353
• Weighted residual factors for all reflections included in the refinement: 0.1574
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No