Information card for entry 4063256

Structure parameters

• Formula: C6 B2 F10 K2
• Calculated formula: C6 B2 F10 K2
• SMILES: [K+].[K+].F[B](F)(F)c1c(c(F)c(F)c(F)c1F)[B](F)(F)F
• Title of publication: Bifunctional Perfluoroaryl Boranes: Synthesis and Coordination Chemistry with Neutral Lewis Base Donors
• Authors of publication: Preston A. Chase; Lee D. Henderson; Warren E. Piers; Masood Parvez; William Clegg; Mark R. J. Elsegood
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 2
• Pages of publication: 349 - 357
• a: 7.046 ± 0.002 Å
• b: 15.853 ± 0.006 Å
• c: 9.341 ± 0.004 Å
• α: 90°
• β: 104.46 ± 0.02°
• γ: 90°
• Cell volume: 1010.3 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.05
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0695
• Weighted residual factors for all reflections included in the refinement: 0.0899
• Goodness-of-fit parameter for all reflections included in the refinement: 0.973
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No