Information card for entry 4342995

Structure parameters

• Formula: C20.5 H23 Ag1.5 F4.5 N O6.5 S3.5
• Calculated formula: C20.5 H23 Ag1.5 F4.5 N O6.5 S3.5
• Title of publication: Coordination Networks of a Ditopic Macrocycle Exhibiting Anion-Controlled Dimensional Changes and Crystal-to-Crystal Anion Exchange.
• Authors of publication: Lee, Eunji; Park, Ki-Min; Ikeda, Mari; Kuwahara, Shunsuke; Habata, Yoichi; Lee, Shim Sung
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 11
• Pages of publication: 5372 - 5383
• a: 10.1091 ± 0.0003 Å
• b: 19.8081 ± 0.0006 Å
• c: 25.7293 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5152.1 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.0318
• Residual factor for significantly intense reflections: 0.0248
• Weighted residual factors for significantly intense reflections: 0.0558
• Weighted residual factors for all reflections included in the refinement: 0.0598
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No