Information card for entry 2222807

Structure parameters

• Chemical name: <i>trans</i>-Di-μ-carbonyl-bis{carbonyl[η^5^-2,3,4,5-tetramethyl-1-(5-methyl- 2-furyl)cyclopentadienyl]ruthenium(I)}
• Formula: C32 H34 O6 Ru2
• Calculated formula: C32 H34 O6 Ru2
• SMILES: C(#[O])[Ru]123456([c]7([c]1(C)[c]3([c]4([c]57C)C)C)c1ccc(o1)C)C(=O)[Ru]13456(C2=O)(C#[O])[c]2([c]1([c]3([c]4([c]52C)C)C)C)c1ccc(o1)C
• Title of publication: <i>trans</i>-Di-μ-carbonyl-bis{carbonyl[η^5^-2,3,4,5-tetramethyl-1-(5-methyl-2-furyl)cyclopentadienyl]ruthenium(I)}(<i>Ru</i>—<i>Ru</i>)
• Authors of publication: Wang, Hong; Dong, Gui-Ying; Ma, Zhi-Hong; Liu, Xiao-Huan; Lin, Jin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 8
• Pages of publication: m895
• a: 8.504 ± 0.003 Å
• b: 16.978 ± 0.007 Å
• c: 10.223 ± 0.004 Å
• α: 90°
• β: 102.22 ± 0.006°
• γ: 90°
• Cell volume: 1442.6 ± 1 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 4
• 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: 0.0378
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.0867
• Weighted residual factors for all reflections included in the refinement: 0.0876
• Goodness-of-fit parameter for all reflections included in the refinement: 1.284
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes