Information card for entry 2214850

Structure parameters

• Chemical name: Acetonitrile(6,6'-dimethyl-2,2'-dipyridyl)silver(I) trifluoromethanesulfonate
• Formula: C15 H15 Ag F3 N3 O3 S
• Calculated formula: C15 H15 Ag F3 N3 O3 S
• SMILES: [Ag]1([n]2c(c3[n]1c(ccc3)C)cccc2C)[N]#CC.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Acetonitrile(6,6'-dimethyl-2,2'-dipyridyl)silver(I) trifluoromethanesulfonate
• Authors of publication: Klausmeyer, Kevin K.; Hung-Low, Fernando; Renz, Amanda
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: m2181 - m2181
• a: 21.9546 ± 0.0011 Å
• b: 6.9806 ± 0.0004 Å
• c: 22.6474 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3470.9 ± 0.3 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 7
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.032
• Residual factor for significantly intense reflections: 0.0253
• Weighted residual factors for significantly intense reflections: 0.0581
• Weighted residual factors for all reflections included in the refinement: 0.0621
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes