Information card for entry 7210211

Structure parameters

• Formula: C64 H42 Ag4 F24 N18 O16 S8
• Calculated formula: C64 H42 Ag4 F24 N18 O16 S8
• SMILES: [Ag]123[n]4cc5c(cccc5)c[n]4[Ag]([n]4cc5ccccc5c[n]4[Ag]4[n]5cc6c(c[n]5[Ag]([n]5cc7c(c[n]35)cccc7)[n]3cc5ccccc5c[n]43)cccc6)([n]3cc4c(cccc4)c[n]13)[n]1cc3c(c[n]21)cccc3.C(F)(F)(F)S(=O)([O-])=NS(=O)(=O)C(F)(F)F.C(F)(F)(F)S(=O)([O-])=NS(=O)(=O)C(F)(F)F.C(F)(F)(F)S(=O)([O-])=NS(=O)(=O)C(F)(F)F.C(F)(F)(F)S(=O)([O-])=NS(=O)(=O)C(F)(F)F
• Title of publication: Stacks and clips: Uncanny similarities in the modes of self-assembly in tenary Ag(I) complexes with 1,2-diazines and chelating heteroarenes.
• Authors of publication: Türkmen, Yunus E.; Sen, Saikat; Rawal, Viresh H.
• Journal of publication: CrystEngComm / RSC
• Year of publication: 2013
• Journal volume: 2013
• Journal issue: 21
• Pages of publication: 4221 - 4224
• a: 18.812 ± 0.0019 Å
• b: 22.261 ± 0.002 Å
• c: 20.92 ± 0.002 Å
• α: 90°
• β: 110.691 ± 0.002°
• γ: 90°
• Cell volume: 8195.7 ± 1.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0754
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.0866
• Weighted residual factors for all reflections included in the refinement: 0.1002
• Goodness-of-fit parameter for all reflections included in the refinement: 0.901
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No