Information card for entry 7223583

Structure parameters

• Formula: C66 H82 Ag2 Cl6 F12 N8 S8 Sb2
• Calculated formula: C66 H82 Ag2 Cl6 F12 N8 S8 Sb2
• Title of publication: Molecular tectonics: dimensionality and geometry control of silver coordination networks based on pyrazolyl appended thiacalixarenes
• Authors of publication: Ovsyannikov, A. S.; Noamane, M. H.; Abidi, R.; Ferlay, S.; Solovieva, S. E.; Antipin, I. S.; Konovalov, A. I.; Kyritsakas, N.; Hosseini, M. W.
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 5
• Pages of publication: 691
• a: 15.6888 ± 0.0004 Å
• b: 17.4322 ± 0.0005 Å
• c: 17.6605 ± 0.0005 Å
• α: 80.598 ± 0.001°
• β: 76.588 ± 0.001°
• γ: 71.025 ± 0.001°
• Cell volume: 4422.6 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0973
• Residual factor for significantly intense reflections: 0.0646
• Weighted residual factors for significantly intense reflections: 0.1905
• Weighted residual factors for all reflections included in the refinement: 0.2215
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No