Information card for entry 4341445

Structure parameters

• Formula: C60 H56 Ag2 F6 N10 O6 P2 S2
• Calculated formula: C60 H56 Ag2 F6 N10 O6 P2 S2
• SMILES: c12cc(ccc1)C1n3ccc[n]3[Ag]([n]3cccn13)[P](c1cc(ccc1)C1n3ccc[n]3[Ag]([P]2(c2ccc(cc2)C)c2ccc(cc2)C)[n]2cccn12)(c1ccc(cc1)C)c1ccc(cc1)C.FC(F)(F)S(=O)(=O)[O-].C(#N)C.FC(F)(F)S(=O)(=O)[O-].C(#N)C
• Title of publication: Isomer Dependence in the Assembly and Lability of Silver(I) Trifluoromethanesulfonate Complexes of the Heteroditopic Ligands, 2-, 3-, and 4-[Di(1H-pyrazolyl)methyl]phenyl(di-p-tolyl)phosphine
• Authors of publication: Gardinier, James R.; Hewage, Jeewantha S.; Lindeman, Sergey V.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2014
• Pages of publication: 141106150122003
• a: 11.8539 ± 0.0002 Å
• b: 15.5905 ± 0.0003 Å
• c: 17.639 ± 0.0004 Å
• α: 90°
• β: 109.318 ± 0.002°
• γ: 90°
• Cell volume: 3076.29 ± 0.11 ų
• Cell temperature: 100.05 ± 0.1 K
• Ambient diffraction temperature: 100.05 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0451
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0712
• Weighted residual factors for all reflections included in the refinement: 0.0777
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No