Information card for entry 4340024

Structure parameters

• Formula: C35 H39 B2 Cu F8 N14
• Calculated formula: C35 H39 B2 Cu F8 N14
• Title of publication: Copper and Silver Complexes of Tris(triazole)amine and Tris(benzimidazole)amine Ligands: Evidence that Catalysis of an Azide-Alkyne Cycloaddition ("Click") Reaction by a Silver Tris(triazole)amine Complex Arises from Copper Impurities.
• Authors of publication: Connell, Timothy U.; Schieber, Christine; Silvestri, Ilaria Proietti; White, Jonathan M.; Williams, Spencer J.; Donnelly, Paul S.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 13
• Pages of publication: 6503 - 6511
• a: 12.537 ± 0.005 Å
• b: 12.735 ± 0.005 Å
• c: 14.852 ± 0.005 Å
• α: 108.124 ± 0.005°
• β: 103.591 ± 0.005°
• γ: 106.069 ± 0.005°
• Cell volume: 2027.3 ± 1.3 ų
• Cell temperature: 130 ± 0.1 K
• Ambient diffraction temperature: 130 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0732
• Residual factor for significantly intense reflections: 0.0662
• Weighted residual factors for significantly intense reflections: 0.1773
• Weighted residual factors for all reflections included in the refinement: 0.1805
• Goodness-of-fit parameter for all reflections included in the refinement: 1.147
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No