Information card for entry 4086638

Structure parameters

• Formula: C53 H46 Ag F3 N2 O3 S5
• Calculated formula: C53 H46 Ag F3 N2 O3 S5
• SMILES: [S+](C(=S(=NC)(c1ccccc1)c1ccccc1)[Ag]C([S+](c1ccccc1)c1ccccc1)=S(=NC)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Syntheses and Structural Characterization of Mono-, Di-, and Tetranuclear Silver Carbone Complexes
• Authors of publication: Morosaki, Tomohito; Suzuki, Tsubasa; Fujii, Takayoshi
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 16
• Pages of publication: 2715
• a: 11.832 ± 0.003 Å
• b: 18.486 ± 0.006 Å
• c: 12.634 ± 0.003 Å
• α: 90°
• β: 117.665 ± 0.008°
• γ: 90°
• Cell volume: 2447.5 ± 1.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0301
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for significantly intense reflections: 0.0575
• Weighted residual factors for all reflections included in the refinement: 0.0594
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No