Information card for entry 4118894

Structure parameters

• Common name: (C5Me5)2Dy(allyl)
• Formula: C23 H35 Dy
• Calculated formula: C23 H35 Dy
• SMILES: [Dy]123456789%10([c]%11([c]4([c]3([c]2([c]1%11C)C)C)C)C)([c]1([c]8([c]7([c]6([c]51C)C)C)C)C)[CH2]=[CH]%10C9
• Title of publication: Exchange Coupling and Magnetic Blocking in Bipyrimidyl Radical-Bridged Dilanthanide Complexes
• Authors of publication: Selvan Demir; Joseph M. Zadrozny; Michael Nippe; Jeffrey R. Long
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 18546 - 18549
• a: 22.618 ± 0.005 Å
• b: 22.618 ± 0.005 Å
• c: 8.397 ± 0.005 Å
• α: 90 ± 0.005°
• β: 90 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 4296 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 82
• Hermann-Mauguin space group symbol: I -4
• Hall space group symbol: I -4
• Residual factor for all reflections: 0.0147
• Residual factor for significantly intense reflections: 0.0146
• Weighted residual factors for significantly intense reflections: 0.0362
• Weighted residual factors for all reflections included in the refinement: 0.0362
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No