Information card for entry 7017150

Structure parameters

• Common name: (acetonitrile-bis(mu-5,7-dimethyl-1,2,4-triazolo(1,5- a)pyrimidine)disilver(i)) tetrafluoroborate perchlorate
• Chemical name: [acetonitrile-bis(μ-5,7-dimethyl-1,2,4- triazolo[1,5-a]pyrimidine)disilver(I)] tetrafluoroborate perchlorate
• Formula: C16 H19 Ag2 Cl F6 N9 O4 P
• Calculated formula: C16 H19 Ag2 Cl F6 N9 O4 P
• SMILES: [Ag]([n]1c2[n]([Ag]3)cnn2c(cc1C)C)([n]1c2[n]3cnn2c(cc1C)C)[N]#CC.Cl(=O)(=O)(=O)[O-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Dinuclear silver(i) complexes for the design of metal-ligand networks based on triazolopyrimidines.
• Authors of publication: Caballero, Ana B.; Maclaren, Jana K.; Rodríguez-Diéguez, Antonio; Vidal, Isaac; Dobado, Jose A.; Salas, Juan M.; Janiak, Christoph
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 44
• Pages of publication: 11845 - 11855
• a: 11.228 ± 0.005 Å
• b: 11.471 ± 0.005 Å
• c: 12.191 ± 0.005 Å
• α: 110.932 ± 0.005°
• β: 112.874 ± 0.005°
• γ: 97.284 ± 0.005°
• Cell volume: 1285.2 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0521
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.1123
• Weighted residual factors for all reflections included in the refinement: 0.119
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No