Information card for entry 7006700

Structure parameters

• Common name: [(LH)Zn(L)Zn(L)Li(OEt2)]
• Formula: C52 H89 Li N6 O Zn2
• Calculated formula: C52 H89 Li N6 O Zn2
• SMILES: [Zn]12([N]3([Zn]4([N]1(c1c3cccc1)CC(C)(C)C)N(c1c([NH]4CC(C)(C)C)cccc1)CC(C)(C)C)CC(C)(C)C)[N]1([Li]([O](CC)CC)[N]2(c2c1cccc2)CC(C)(C)C)CC(C)(C)C
• Title of publication: Synthesis and structures of some bimetallic (Li/Ca, Li/Zn, Li/Li) diamides derived from 1,2-bis(neopentylamino)benzene and of Li2[{N(SiMe2NPr(i)2)}2C6H4-1,2](thf)3.
• Authors of publication: Hitchcock, Peter B.; Lappert, Michael F.; Wei, Xue-Hong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 9
• Pages of publication: 1181 - 1187
• a: 11.9582 ± 0.0003 Å
• b: 14.8108 ± 0.0005 Å
• c: 16.8878 ± 0.0005 Å
• α: 85.507 ± 0.002°
• β: 77.579 ± 0.002°
• γ: 68.404 ± 0.001°
• Cell volume: 2715.95 ± 0.14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0863
• Residual factor for significantly intense reflections: 0.0604
• Weighted residual factors for significantly intense reflections: 0.1442
• Weighted residual factors for all reflections included in the refinement: 0.1603
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No