Information card for entry 2216133

Structure parameters

• Chemical name: Chloridobis(η^5^-cyclopentadienyl)(4-methoxyphenethyl)zirconium(IV)
• Formula: C19 H21 Cl O Zr
• Calculated formula: C19 H21 Cl O Zr
• Title of publication: Chloridobis(η^5^-cyclopentadienyl)(4-methoxyphenethyl)zirconium(IV)
• Authors of publication: Burford, Richard; Garon, Christian N.; Fontaine, Frédéric-Georges; Westcott, Stephen A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2790 - m2790
• a: 6.8095 ± 0.0007 Å
• b: 12.3823 ± 0.0012 Å
• c: 20.645 ± 0.002 Å
• α: 90°
• β: 93.198 ± 0.001°
• γ: 90°
• Cell volume: 1738 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0242
• Residual factor for significantly intense reflections: 0.0223
• Weighted residual factors for significantly intense reflections: 0.0576
• Weighted residual factors for all reflections included in the refinement: 0.0589
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes