Information card for entry 4064341

Structure parameters

• Formula: C132 H224 B8 Li4 N8 O12
• Calculated formula: C132 H224 B8 Li4 N8 O12
• Title of publication: Anionic N-Heterocyclic Dicarbene−Borane Binuclear Complexes
• Authors of publication: Wang, Yuzhong; Xie, Yaoming; Abraham, Mariham Y.; Wei, Pingrong; Schaefer, Henry F.; Schleyer, Paul v. R.; Robinson, Gregory H.
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 6
• Pages of publication: 1303
• a: 18.509 ± 0.0017 Å
• b: 16.5228 ± 0.0015 Å
• c: 24.285 ± 0.002 Å
• α: 90°
• β: 96.228 ± 0.001°
• γ: 90°
• Cell volume: 7383 ± 1.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.2631
• Residual factor for significantly intense reflections: 0.0828
• Weighted residual factors for significantly intense reflections: 0.1766
• Weighted residual factors for all reflections included in the refinement: 0.249
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No