Information card for entry 2233345

Structure parameters

• Chemical name: Bis{2-[(pyridin-4-yl-κ<i>N</i>)sulfanyl]pyrazine}silver(I) tetrafluoridoborate
• Formula: C18 H14 Ag B F4 N6 S2
• Calculated formula: C18 H14 Ag B F4 N6 S2
• SMILES: [Ag]([n]1ccc(Sc2nccnc2)cc1)[n]1ccc(Sc2nccnc2)cc1.[B](F)(F)(F)[F-]
• Title of publication: Bis{2-[(pyridin-4-yl-κ<i>N</i>)sulfanyl]pyrazine}silver(I) tetrafluoridoborate
• Authors of publication: Wang, Zi-Jia
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 1
• Pages of publication: m4
• a: 7.2232 ± 0.0002 Å
• b: 16.4826 ± 0.0003 Å
• c: 17.6098 ± 0.0004 Å
• α: 90°
• β: 91.666 ± 0.001°
• γ: 90°
• Cell volume: 2095.69 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• 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: 0.0405
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.111
• Weighted residual factors for all reflections included in the refinement: 0.116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes