Information card for entry 4076854

Structure parameters

• Formula: C32 H48 O Si2 Zr
• Calculated formula: C32 H48 O Si2 Zr
• Title of publication: Reactions of Zirconocene−Alkyne Complexes with Polar Functionalized Olefins†
• Authors of publication: Sun, Hongsui; Burlakov, Vladimir V.; Spannenberg, Anke; Baumann, Wolfgang; Arndt, Perdita; Rosenthal, Uwe
• Journal of publication: Organometallics
• Year of publication: 2002
• Journal volume: 21
• Journal issue: 16
• Pages of publication: 3360
• a: 11.067 ± 0.002 Å
• b: 11.134 ± 0.002 Å
• c: 13.521 ± 0.003 Å
• α: 108.19 ± 0.03°
• β: 95.02 ± 0.03°
• γ: 97.93 ± 0.03°
• Cell volume: 1552.5 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0493
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for all reflections: 0.109
• Weighted residual factors for significantly intense reflections: 0.1003
• Goodness-of-fit parameter for all reflections: 1.021
• Goodness-of-fit parameter for significantly intense reflections: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No