Information card for entry 2012444

Structure parameters

• Chemical name: trans-bis(acetonitrile)-bis(di-2-pyridylsulfide-N,N')-ruthenium(ii) bis(tetrafluoroborate) monohydrate
• Formula: C24 H24 B2 F8 N6 O Ru S2
• Calculated formula: C24 H24 B2 F8 N6 O Ru S2
• Title of publication: <i>trans</i>-Diacetonitrilebis(di-2-pyridyl sulfide-<i>N,N</i>')ruthenium(II) bis(tetrafluoroborate) monohydrate
• Authors of publication: Bruno, Giuseppe; Nicoló, Francesco; Tresoldi, Giuseppe; Lanza, Santo
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 1
• Pages of publication: m56 - m58
• a: 10.0709 ± 0.0007 Å
• b: 12.6595 ± 0.0008 Å
• c: 13.547 ± 0.001 Å
• α: 77.016 ± 0.007°
• β: 75.004 ± 0.006°
• γ: 68.225 ± 0.006°
• Cell volume: 1533.3 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0443
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0852
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes