Information card for entry 2233289

Structure parameters

• Chemical name: <i>cis</i>-Bis(acetonitrile-κ<i>N</i>)bis(2,2'-bipyridine- κ^2^<i>N</i>,<i>N</i>')ruthenium(II) tetrafluoridoborate
• Formula: C24 H22 B2 F8 N6 Ru
• Calculated formula: C24 H22 B2 F8 N6 Ru
• SMILES: [Ru]12([n]3ccccc3c3cccc[n]13)([n]1ccccc1c1cccc[n]21)([N]#CC)[N]#CC.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-]
• Title of publication: <i>cis</i>-Bis(acetonitrile-κ<i>N</i>)bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')ruthenium(II) tetrafluoridoborate
• Authors of publication: Wang, Ying; Xu, Feng; Huang, Wei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 1
• Pages of publication: m68
• a: 10.5648 ± 0.0007 Å
• b: 24.0246 ± 0.0017 Å
• c: 10.4561 ± 0.0007 Å
• α: 90°
• β: 90.253 ± 0.001°
• γ: 90°
• Cell volume: 2653.9 ± 0.3 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0647
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1118
• Weighted residual factors for all reflections included in the refinement: 0.1205
• Goodness-of-fit parameter for all reflections included in the refinement: 0.947
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes