Information card for entry 4069298

Structure parameters

• Formula: C92 H110 N12 Yb2
• Calculated formula: C92 H110 N12 Yb2
• Title of publication: Reactions of Cp*2Yb(THF)2with TCNQ and TCNB. A Novel Type of Reactivity of TCNQ toward Metallocenes. The First Example of the π-Dimer [TCNB2]2−
• Authors of publication: Trifonov, Alexander A.; Gudilenkov, Ivan D.; Fukin, Georgy K.; Cherkasov, Anton V.; Larionova, Julia
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 12
• Pages of publication: 3421
• a: 13.7777 ± 0.0004 Å
• b: 21.9832 ± 0.0006 Å
• c: 14.9658 ± 0.0004 Å
• α: 90°
• β: 106.868 ± 0.001°
• γ: 90°
• Cell volume: 4337.8 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0394
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.0787
• Weighted residual factors for all reflections included in the refinement: 0.0826
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No