Information card for entry 7002011

Structure parameters

• Formula: C29 H51 I3 N4 P Pd Rh
• Calculated formula: C29 H51 I3 N4 P Pd Rh
• SMILES: I[Pd](I)([P](CC)(CC)CC)=C1N(C(C)(C)C)C=CN1CN1C(=[Rh]234(I)[CH]5=[CH]2CC[CH]3=[CH]4CC5)N(C=C1)C(C)(C)C
• Title of publication: Carbene-anchored/pendent-imidazolium species as precursors to di-N-heterocyclic carbene-bridged mixed-metal complexes
• Authors of publication: Zamora, Matthew T.; Ferguson, Michael J.; McDonald, Robert; Cowie, Martin
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 35
• Pages of publication: 7269
• a: 15.4844 ± 0.0014 Å
• b: 11.9963 ± 0.0011 Å
• c: 40.421 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7508.4 ± 1.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0271
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.055
• Weighted residual factors for all reflections included in the refinement: 0.056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.208
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No