Information card for entry 1100884

Structure parameters

• Formula: C41.5 H52 Er N2 P2 Si2
• Calculated formula: C41.5 H47 Er N2 P2 Si2
• Title of publication: Cyclooctatetraene Complexes of Yttrium and the Lanthanides with Bis(phosphinimino)methanides: Synthesis, Structure, and Hydroamination/Cyclization Catalysis
• Authors of publication: Panda, Tarun K.; Zulys, Agustino; Gamer, Michael T.; Roesky, Peter W.
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 9
• Pages of publication: 2197 - 2202
• a: 9.3791 ± 0.0017 Å
• b: 9.4895 ± 0.0017 Å
• c: 22.693 ± 0.004 Å
• α: 93.345 ± 0.004°
• β: 92.875 ± 0.004°
• γ: 98.921 ± 0.004°
• Cell volume: 1988.3 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.033
• Residual factor for significantly intense reflections: 0.0262
• Weighted residual factors for significantly intense reflections: 0.0607
• Weighted residual factors for all reflections included in the refinement: 0.0653
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 4060419
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No