Information card for entry 4072192

Structure parameters

• Formula: C70 H80 Cl8 O4 P4 Zr2
• Calculated formula: C70 H80 Cl8 O4 P4 Zr2
• Title of publication: Zirconium Complexes Containing Tetradentate O,P,P,O Ligands: Ethylene and Propylene Polymerization Studies
• Authors of publication: Long, Richard J.; Jones, David J.; Gibson, Vernon C.; White, Andrew J. P.
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 22
• Pages of publication: 5960
• a: 25.638 ± 0.003 Å
• b: 13.5433 ± 0.0015 Å
• c: 23.532 ± 0.003 Å
• α: 90°
• β: 115.018 ± 0.011°
• γ: 90°
• Cell volume: 7404.2 ± 1.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.0458
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0852
• Weighted residual factors for all reflections included in the refinement: 0.0886
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No