Information card for entry 7103256

Structure parameters

• Formula: C17 H37 Li N2
• Calculated formula: C17 H37 Li N2
• SMILES: C(C)[N]1(CC)[C@@H]2CCCC[C@H]2[N](CC)(CC)[Li]1[CH](C)C
• Title of publication: Isopropyllithium diamine adducts: from a non symmetric aggregate to monomeric i-PrLi.(1R,2R)-N,N,N',N'-tetraethylcyclohexane-1,2-diamine.
• Authors of publication: Strohmann, Carsten; Gessner, Viktoria H; Damme, A
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 29
• Pages of publication: 3381 - 3383
• a: 7.798 ± 0.003 Å
• b: 14.839 ± 0.006 Å
• c: 16.313 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1887.7 ± 1.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0674
• Residual factor for significantly intense reflections: 0.0525
• Weighted residual factors for significantly intense reflections: 0.1153
• Weighted residual factors for all reflections included in the refinement: 0.1216
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No