Information card for entry 7242490

Structure parameters

• Formula: C20 H22
• Calculated formula: C20 H22
• Title of publication: Synthesis of zirconocene complexes and their use in slurry-phase polymerisation of ethylene
• Authors of publication: Angpanitcharoen, Phakpoom; Lamb, Jessica V.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot
• Journal of publication: RSC Advances
• Year of publication: 2021
• Journal volume: 11
• Journal issue: 19
• Pages of publication: 11529 - 11535
• a: 5.8532 ± 0.0001 Å
• b: 24.6468 ± 0.0005 Å
• c: 10.7323 ± 0.0002 Å
• α: 90°
• β: 99.656 ± 0.002°
• γ: 90°
• Cell volume: 1526.34 ± 0.05 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 0.2 K
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0564
• Residual factor for significantly intense reflections: 0.0494
• Weighted residual factors for significantly intense reflections: 0.1467
• Weighted residual factors for all reflections included in the refinement: 0.153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No