Information card for entry 7010586

Structure parameters

• Chemical name: (Et4N){Ru[S2C2(CN)2]2(py)2}
• Formula: C26 H30 N7 Ru S4
• Calculated formula: C26 H30 N7 Ru S4
• Title of publication: The chemistry of ruthenium complexes of 1,2-dicyanoethylene dithiolate (mnt2‒). Synthesis and characterization of [RuIV/III(mnt)3]2‒/3‒ and the derivatives trans-[RuIII(mnt)2(PPh3)2]‒, trans-[RuIII(mnt)2(py)2]‒ and trans-[RuIV(mnt)2(Br)2]2‒
• Authors of publication: Maiti, Rabindranath; Shang, Maoyu; Lappin, A. Graham
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 2
• Pages of publication: 244
• a: 16.268 ± 0.005 Å
• b: 14.078 ± 0.003 Å
• c: 15.039 ± 0.003 Å
• α: 90°
• β: 116.82 ± 0.02°
• γ: 90°
• Cell volume: 3073.7 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0405
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for all reflections: 0.1029
• Weighted residual factors for significantly intense reflections: 0.098
• Goodness-of-fit parameter for all reflections: 1.068
• Goodness-of-fit parameter for significantly intense reflections: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No