Information card for entry 7022509

Structure parameters

• Formula: C31 H47 Al2 N2 Y
• Calculated formula: C31 H47 Al2 N2 Y
• SMILES: [Y]123([CH3][Al]([CH3]3)(C)C)([CH3][Al]([CH3]2)(C)C)[N](=C(N1c1c(cccc1C)C)c1ccccc1)c1c(cccc1C)C
• Title of publication: Synthesis of mono-amidinate-ligated rare-earth-metal bis(silylamide) complexes and their reactivity with [Ph3C][B(C6F5)4], AlMe3 and isoprene.
• Authors of publication: Luo, Yunjie; Lei, Yinlin; Fan, Shimin; Wang, Yibin; Chen, Jue
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 11
• Pages of publication: 4040 - 4051
• a: 14.094 ± 0.003 Å
• b: 14.327 ± 0.003 Å
• c: 16.524 ± 0.004 Å
• α: 90°
• β: 98.951 ± 0.006°
• γ: 90°
• Cell volume: 3296 ± 1.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1116
• Residual factor for significantly intense reflections: 0.0732
• Weighted residual factors for significantly intense reflections: 0.1568
• Weighted residual factors for all reflections included in the refinement: 0.1755
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No