Information card for entry 4314926

Structure parameters

• Formula: C131 H156 N8 U Yb2
• Calculated formula: C110 H132 N8 U Yb2
• SMILES: [U]12345678(N=C(Cc9ccccc9)c9cc%10[n]%11[Yb]%12%13%14%15%16%17%18%19([n]%20c%10cccc%20)([n]%10c(c%11c9)cccc%10)([c]9([c]%12([c]%13([c]%14([c]%159C)C)C)CC)C)[c]9([c]%16([c]%19([c]%17([c]%189CC)C)C)C)C)(N=C(Cc9ccccc9)c9cc%10[n]%11[Yb]%12%13%14%15%16%17%18%19([n]%20c%10cccc%20)([n]%10c(c%11c9)cccc%10)([c]9([c]%15([c]%14([c]%13([c]%129C)C)CC)C)C)[c]9([c]%18([c]%19([c]%17([c]%169C)C)C)C)CC)([c]9([c]1([c]2([c]3([c]49C)C)C)C)C)[c]1([c]5([c]6([c]7([c]81C)C)C)C)C
• Title of publication: Comparative Study of f-Element Electronic Structure across a Series of Multimetallic Actinide and Lanthanoid-Actinide Complexes Possessing Redox-Active Bridging Ligands
• Authors of publication: Eric J. Schelter; Ruilian Wu; Jacqueline M. Veauthier; Eric D. Bauer; Corwin H. Booth; Robert K. Thomson; Christopher R. Graves; Kevin D. John; Brian L. Scott; Joe D. Thompson; David E. Morris; Jaqueline L. Kiplinger
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 1995 - 2007
• a: 13.3201 ± 0.0013 Å
• b: 17.9749 ± 0.0018 Å
• c: 24.197 ± 0.002 Å
• α: 104.71 ± 0.002°
• β: 92.122 ± 0.002°
• γ: 90.266 ± 0.002°
• Cell volume: 5599.1 ± 0.9 ų
• Cell temperature: 141 ± 2 K
• Ambient diffraction temperature: 141 ± 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: 0.072
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.1112
• Weighted residual factors for all reflections included in the refinement: 0.1204
• Goodness-of-fit parameter for all reflections included in the refinement: 0.893
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No