Information card for entry 4123140

Structure parameters

• Formula: C130.39 H106.49 Ag2 F6 N4 O8 S2
• Calculated formula: C130.392 H106.49 Ag2 F6 N4 O8 S2
• Title of publication: Multipoint Recognition of Ditopic Aromatic Guest Molecules via Ag-π Interactions within a Dimetal Macrocycle.
• Authors of publication: Omoto, Kenichiro; Tashiro, Shohei; Kuritani, Masumi; Shionoya, Mitsuhiko
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Pages of publication: 141216134140000
• a: 29.8734 ± 0.0019 Å
• b: 36.531 ± 0.002 Å
• c: 24.3398 ± 0.0014 Å
• α: 90°
• β: 120.035 ± 0.0014°
• γ: 90°
• Cell volume: 22995 ± 2 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1988
• Residual factor for significantly intense reflections: 0.1276
• Weighted residual factors for significantly intense reflections: 0.3483
• Weighted residual factors for all reflections included in the refinement: 0.3917
• Goodness-of-fit parameter for all reflections included in the refinement: 1.217
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No