Information card for entry 1548383

Structure parameters

• Formula: C73.5 H68 Ag5 F9 N18 O12.5 S3
• Calculated formula: C73.5 H68 Ag5 F9 N18 O12.5 S3
• Title of publication: Synthesis of stable polymetalated aromatic complexes through metal-macrocycle capsule-triggered cyclization.
• Authors of publication: He, Xin; Xue, Yang; Li, Cui-Cui; Wang, Yuechao; Jiang, Hong; Zhao, Liang
• Journal of publication: Chemical science
• Year of publication: 2018
• Journal volume: 9
• Journal issue: 6
• Pages of publication: 1481 - 1487
• a: 14.8347 ± 0.0003 Å
• b: 15.7643 ± 0.0003 Å
• c: 18.6915 ± 0.0004 Å
• α: 96.459 ± 0.002°
• β: 93.928 ± 0.002°
• γ: 95.369 ± 0.002°
• Cell volume: 4310.55 ± 0.15 ų
• Cell temperature: 173 ± 0.1 K
• Ambient diffraction temperature: 173 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0573
• Residual factor for significantly intense reflections: 0.0534
• Weighted residual factors for significantly intense reflections: 0.1529
• Weighted residual factors for all reflections included in the refinement: 0.1578
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No