Information card for entry 7224194

Structure parameters

• Common name: n-Ag2[C-ethyl tetramethoxy resorcinarene bis-thiacrown][trifluoroacetate]2 dichloromethane ethanol solvate hydrate
• Chemical name: n-Ag2[C-ethyl tetramethoxy resorcinarene bis-thiacrown][trifluoroacetate]2 dichloromethane ethanol solvate hydrate
• Formula: C135 H202 Ag4 Cl6 F12 O34 S12
• Calculated formula: C133 H188 Ag4 Cl6 F12 O33 S12
• Title of publication: Inverted molecular cups: 1-D and 2-D Ag(i) coordination polymers from resorcinarene bis-thiacrowns
• Authors of publication: Helttunen, Kaisa; Nissinen, Maija
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 26
• Pages of publication: 4944
• a: 18.1183 ± 0.0003 Å
• b: 19.5986 ± 0.0004 Å
• c: 24.7135 ± 0.0005 Å
• α: 75.385 ± 0.0007°
• β: 83.625 ± 0.0006°
• γ: 74.064 ± 0.0011°
• Cell volume: 8157.1 ± 0.3 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.1226
• Residual factor for significantly intense reflections: 0.0952
• Weighted residual factors for significantly intense reflections: 0.2465
• Weighted residual factors for all reflections included in the refinement: 0.2636
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No