Information card for entry 7039422

Structure parameters

• Formula: C42 H66 Li N2 O2 Ta
• Calculated formula: C42 H66 Li N2 O2 Ta
• Title of publication: Synthesis and reactivity of Li and TaMe3 complexes supported by N,N'-bis(2,6-diisopropylphenyl)-o-phenylenediamido ligands.
• Authors of publication: Janes, Trevor; Xu, Maotong; Song, Datong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 26
• Pages of publication: 10672 - 10680
• a: 21.192 ± 0.0016 Å
• b: 18.2269 ± 0.0012 Å
• c: 21.3088 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8230.8 ± 1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0647
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0797
• Weighted residual factors for all reflections included in the refinement: 0.116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.15
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No