Information card for entry 7039555

Structure parameters

• Formula: C34 H44 Li2 N2 O2
• Calculated formula: C34 H44 Li2 N2 O2
• SMILES: [Li]1([O](CC)CC)[N](CC=C)(c2cccc3ccccc23)[Li]([O](CC)CC)[N]1(CC=C)(c1cccc2ccccc12)
• Title of publication: Simplifying metal-'ate' chemistry: formation and comprehensive characterisation of a homo-metallic amido lithiate complex.
• Authors of publication: Greer, Jamie A.; Blair, Victoria L.; Thompson, Christopher D.; Andrews, Philip C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 27
• Pages of publication: 10887 - 10890
• a: 7.9155 ± 0.0005 Å
• b: 9.4118 ± 0.0008 Å
• c: 10.9072 ± 0.0009 Å
• α: 92.056 ± 0.005°
• β: 96.772 ± 0.004°
• γ: 108.294 ± 0.004°
• Cell volume: 763.83 ± 0.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0806
• Residual factor for significantly intense reflections: 0.0509
• Weighted residual factors for significantly intense reflections: 0.1355
• Weighted residual factors for all reflections included in the refinement: 0.1496
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No