Information card for entry 7024952

Structure parameters

• Formula: C56 H40 Ag2 F32 N12 O2 Sb2
• Calculated formula: C56 H40 Ag2 F32 N12 O2 Sb2
• SMILES: c1(c(c(c(c(c1Cn1cc2[n](n1)[Ag]([n]1nn(cc1c1cc(c3cn(Cc4c(c(c(c(c4F)F)F)F)F)n[n]3[Ag]([n]3nn(cc3c3cc2ccc3)Cc2c(c(c(c(c2F)F)F)F)F)[O](CC)CC)ccc1)Cc1c(c(c(c(c1F)F)F)F)F)[O](CC)CC)F)F)F)F)F.F[Sb](F)(F)(F)(F)[F-].F[Sb](F)(F)(F)(F)[F-]
• Title of publication: Self-assembly of silver(I) metallomacrocycles using unsupported 1,4-substituted-1,2,3-triazole "click" ligands.
• Authors of publication: Gower, Martin L.; Crowley, James D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 9
• Pages of publication: 2371 - 2378
• a: 10.2003 ± 0.0015 Å
• b: 13.2718 ± 0.0019 Å
• c: 13.3767 ± 0.0021 Å
• α: 66.065 ± 0.006°
• β: 89.354 ± 0.007°
• γ: 89.478 ± 0.007°
• Cell volume: 1655 ± 0.4 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0273
• Residual factor for significantly intense reflections: 0.0239
• Weighted residual factors for significantly intense reflections: 0.0604
• Weighted residual factors for all reflections included in the refinement: 0.071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.137
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No