Information card for entry 4302928

Structure parameters

• Common name: [Li(m3-TEG)]6 (1)
• Formula: C54 H120 Li6 N18
• Calculated formula: C54 H120 Li6 N18
• SMILES: [Li]12[N]3(=C(N(CC)CC)N(CC)CC)[Li]4[N]5(=C(N(CC)CC)N(CC)CC)[Li]3[N]3(=C(N(CC)CC)N(CC)CC)[Li]5[N]5(=C(N(CC)CC)N(CC)CC)[Li]3[N]2(=C(N(CC)CC)N(CC)CC)[Li]5[N]41=C(N(CC)CC)N(CC)CC
• Title of publication: Synthesis, Structure, and Reactivity of Low-Coordinate 1,1,3,3-Tetraethylguanidinate Complexes
• Authors of publication: Scott D. Bunge; Jeffrey A. Bertke; Travis L. Cleland
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 8037 - 8043
• a: 19.0172 ± 0.0006 Å
• b: 19.0172 ± 0.0006 Å
• c: 19.0172 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6877.6 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 201
• Hermann-Mauguin space group symbol: P n -3 :2
• Hall space group symbol: -P 2ab 2bc 3
• Residual factor for all reflections: 0.0603
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.1103
• Weighted residual factors for all reflections included in the refinement: 0.1268
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No