Information card for entry 4074739

Structure parameters

• Formula: C15 H20 Cl2 N2 Ru
• Calculated formula: C15 H20 Cl2 N2 Ru
• SMILES: [Ru]123456(Cl)(Cl)=C7N(C=CN7CC[c]76[cH]3[cH]5[cH]4[cH]1[cH]27)CCCC
• Title of publication: Synthesis of Imidazolium-Tethered Ruthenium(II)-Arene Complexes and Their Application in Biphasic Catalysis
• Authors of publication: Geldbach, Tilmann J.; Laurenczy, Gábor; Scopelliti, Rosario; Dyson, Paul J.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 3
• Pages of publication: 733
• a: 8.4686 ± 0.0008 Å
• b: 8.6857 ± 0.0011 Å
• c: 10.858 ± 0.0011 Å
• α: 76.064 ± 0.01°
• β: 87.346 ± 0.008°
• γ: 84.323 ± 0.009°
• Cell volume: 771.15 ± 0.15 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0374
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0908
• Weighted residual factors for all reflections included in the refinement: 0.0921
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No