Information card for entry 7111057

Structure parameters

• Formula: C28.5 H32.5 Cl N2 Yb0.5
• Calculated formula: C28.5 H32.5 Cl N2 Yb0.5
• Title of publication: A persistent C‒H‥C(π) T-stacked cation
• Authors of publication: Abernethy, Colin D.; Macdonald, Charles L. B.; Cowley, Alan H.; Clyburne, Jason A. C.
• Journal of publication: Chemical Communications
• Year of publication: 2001
• Journal issue: 1
• Pages of publication: 61
• a: 16.785 ± 0.004 Å
• b: 19.727 ± 0.006 Å
• c: 15.847 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5247 ± 2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 52
• Hermann-Mauguin space group symbol: P n n a
• Hall space group symbol: -P 2a 2bc
• Residual factor for all reflections: 0.1014
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for all reflections: 0.0804
• Weighted residual factors for significantly intense reflections: 0.0664
• Goodness-of-fit parameter for all reflections: 1.104
• Goodness-of-fit parameter for significantly intense reflections: 1.237
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No