Information card for entry 4072348

Structure parameters

• Formula: C16 H44 Li2 N4 Zn
• Calculated formula: C16 H44 Li2 N4 Zn
• SMILES: [Li]123([Zn]45([Li]6([N](C)(C)CC[N]6(C)C)([CH3]4)[CH3]5)([CH3]2)[CH3]3)[N](C)(C)CC[N]1(C)C
• Title of publication: Synthesis and Structural Elucidation of Alkyl, Amido, and Mixed Alkyl−Amido “Highly-Coordinated” Zincates
• Authors of publication: Armstrong, David R.; Dougan, Christine; Graham, David V.; Hevia, Eva; Kennedy, Alan R.
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 23
• Pages of publication: 6063
• a: 13.205 ± 0.0004 Å
• b: 14.9516 ± 0.0005 Å
• c: 12.0045 ± 0.0003 Å
• α: 90°
• β: 94.142 ± 0.002°
• γ: 90°
• Cell volume: 2363.93 ± 0.12 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0764
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.0834
• Weighted residual factors for all reflections included in the refinement: 0.0947
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No