Information card for entry 7052406

Structure parameters

• Common name: [Li(N,N'-Dipamidine)(THF)2]
• Formula: C40 H57 Li N2 O2
• Calculated formula: C40 H57 Li N2 O2
• SMILES: [O]1([Li]2(N(c3c(cccc3C(C)C)C(C)C)C(=[N]2c2c(cccc2C(C)C)C(C)C)c2ccc(cc2)C)[O]2CCCC2)CCCC1
• Title of publication: The syntheses and structures of some main group complexes of the sterically hindered N,N?-bis(2,6-diisopropylphenyl)-4-toluamidinate ligand
• Authors of publication: René T. Boeré; Marcus L. Cole; Peter C. Junk
• Journal of publication: New Journal of Chemistry
• Year of publication: 2005
• Journal volume: 29
• Journal issue: 1
• Pages of publication: 128
• a: 10.922 ± 0.003 Å
• b: 11.627 ± 0.002 Å
• c: 15.562 ± 0.004 Å
• α: 80.772 ± 0.009°
• β: 77.567 ± 0.013°
• γ: 77.758 ± 0.011°
• Cell volume: 1872.3 ± 0.8 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.2305
• Residual factor for significantly intense reflections: 0.0719
• Weighted residual factors for significantly intense reflections: 0.1563
• Weighted residual factors for all reflections included in the refinement: 0.2172
• Goodness-of-fit parameter for all reflections included in the refinement: 0.893
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No