Information card for entry 4111821

Structure parameters

• Common name: Zirconocenechloridedisilenide
• Formula: C61 H93 Cl Si2 Zr
• Calculated formula: C61 H93 Cl Si2 Zr
• Title of publication: Activation of a SiSi Bond by η1-Coordination to a Transition Metal
• Authors of publication: Thi-loan Nguyen; David Scheschkewitz
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• Journal volume: 127
• Pages of publication: 10174 - 10175
• a: 10.5012 ± 0.001 Å
• b: 13.497 ± 0.0013 Å
• c: 22.406 ± 0.002 Å
• α: 74.515 ± 0.002°
• β: 81.705 ± 0.002°
• γ: 87.295 ± 0.002°
• Cell volume: 3028.3 ± 0.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0491
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.1116
• Weighted residual factors for all reflections included in the refinement: 0.1176
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No