Information card for entry 7021552

Structure parameters

• Formula: C32 H74 Cl4 N2 O4 P4 Ru2
• Calculated formula: C32 H74 Cl4 N2 O4 P4 Ru2
• SMILES: C([P]1(C(C)C)OCC[NH]2[Ru]31(Cl)([P](C(C)C)(C(C)C)OCC2)[Cl][Ru]12([NH](CCO[P]1(C(C)C)C(C)C)CCO[P]2(C(C)C)C(C)C)(Cl)[Cl]3)(C)C
• Title of publication: Synthesis and reactivity of ruthenium tridentate bis-phosphinite ligand complexes.
• Authors of publication: Sgro, Michael J.; Stephan, Douglas W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 29
• Pages of publication: 10460 - 10472
• a: 8.789 ± 0.0008 Å
• b: 10.408 ± 0.001 Å
• c: 13.7962 ± 0.0013 Å
• α: 91.428 ± 0.004°
• β: 106.792 ± 0.003°
• γ: 114.206 ± 0.003°
• Cell volume: 1087.02 ± 0.18 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0244
• Residual factor for significantly intense reflections: 0.0208
• Weighted residual factors for significantly intense reflections: 0.0495
• Weighted residual factors for all reflections included in the refinement: 0.051
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No