Information card for entry 7241300

Structure parameters

• Formula: C65 H71 Ag Cl9 F3 O15 S9
• Calculated formula: C65 H69 Ag Cl9 F3 O15 S9
• Title of publication: Influence of anion and mole-ratio on the formation of 2-D coordination networks of thiacalix[4]-bis-monothiacrown-5
• Authors of publication: Ju, Huiyeong; Lee, Jai Young; Lee, Shim Sung
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 29.7592 ± 0.0003 Å
• b: 26.2631 ± 0.0003 Å
• c: 20.0331 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 15657.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0911
• Residual factor for significantly intense reflections: 0.0678
• Weighted residual factors for significantly intense reflections: 0.1878
• Weighted residual factors for all reflections included in the refinement: 0.2117
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No