Information card for entry 7011518

Structure parameters

• Common name: 3a
• Formula: C32 H49 N3 Si3 Zr
• Calculated formula: C32 H49 N3 Si3 Zr
• Title of publication: Synthesis, structures, and alkene hydrosilation activities of neutral tripodal amidozirconium alkyls
• Authors of publication: Jia, Li; Zhao, Jiquan; Ding, Errun; Brennessel, William W.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 13
• Pages of publication: 2608
• a: 42.402 ± 0.003 Å
• b: 9.9224 ± 0.0007 Å
• c: 17.614 ± 0.001 Å
• α: 90°
• β: 108.717 ± 0.001°
• γ: 90°
• Cell volume: 7018.8 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0374
• Residual factor for significantly intense reflections: 0.0263
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0712
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No