Information card for entry 7009313

Structure parameters

• Formula: C35 H23 Cl2 Zr
• Calculated formula: C35 H23 Cl2 Zr
• Title of publication: Enantiospecific synthesis of a planar chiral fluorenylzirconium ansa-metallocene: synthesis and structures of [1-(9-fluorenyl)- and [1-(1-methyl-9-fluorenyl)-2-(2-indenyl)naphthalene]zirconium dichloride
• Authors of publication: Baker, Robert W.; Foulkes, Michael A.; Turner, Peter
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 4
• Pages of publication: 431
• a: 12.134 ± 0.002 Å
• b: 12.745 ± 0.002 Å
• c: 10.334 ± 0.002 Å
• α: 98.72 ± 0.01°
• β: 112.29 ± 0.01°
• γ: 68.47 ± 0.01°
• Cell volume: 1375.4 ± 0.4 ų
• Cell temperature: 294.2 K
• Ambient diffraction temperature: 294.2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0516
• Residual factor for significantly intense reflections: 0.0353
• Weighted residual factors for all reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.0398
• Goodness-of-fit parameter for all reflections: 1.886
• Goodness-of-fit parameter for significantly intense reflections: 2.042
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No