Information card for entry 4516454

Structure parameters

• Formula: C68 H56 Ag3 Cl8 F18 N8 P3 S4
• Calculated formula: C68 H56 Ag3 Cl8 F18 N8 P3 S4
• Title of publication: Anion-Directed Coordination Networks of a Flexible S-Pivot Ligand and Anion Exchange in the Solid State
• Authors of publication: Lee, Eunji; Ju, Huiyeong; Kim, Seulgi; Park, Ki-Min; Lee, Shim Sung
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 11
• Pages of publication: 5427
• a: 20.9049 ± 0.0004 Å
• b: 14.6808 ± 0.0003 Å
• c: 14.2515 ± 0.0003 Å
• α: 90°
• β: 108.043 ± 0.001°
• γ: 90°
• Cell volume: 4158.71 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0587
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.0903
• Weighted residual factors for all reflections included in the refinement: 0.1012
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No