Information card for entry 4339447

Structure parameters

• Formula: C42.5 H71.5 O4 S2 Zr
• Calculated formula: C42.5 H71.5 O4 S2 Zr
• Title of publication: Group 4 complexes of a new [OSSO]-type dianionic ligand. Coordination chemistry and preliminary polymerization catalysis studies.
• Authors of publication: Cohen, Ad; Yeori, Adi; Goldberg, Israel; Kol, Moshe
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 20
• Pages of publication: 8114 - 8116
• a: 13.0206 ± 0.0002 Å
• b: 17.7528 ± 0.0002 Å
• c: 19.5067 ± 0.0004 Å
• α: 90°
• β: 93.0593 ± 0.0005°
• γ: 90°
• Cell volume: 4502.59 ± 0.13 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 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: 0.0782
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.117
• Weighted residual factors for all reflections included in the refinement: 0.1314
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No