Information card for entry 4075485

Structure parameters

• Formula: C26 H18 F10 N2 Zn
• Calculated formula: C26 H18 F10 N2 Zn
• SMILES: c1ccc(C[NH2][Zn](c2c(c(c(c(c2F)F)F)F)F)(c2c(c(c(c(c2F)F)F)F)F)[NH2]Cc2ccccc2)cc1
• Title of publication: The Synthesis, Molecular Structures, and Supramolecular Architecture of Amine Adducts of Bis(pentafluorophenyl)zinc
• Authors of publication: Mountford, Andrew J.; Lancaster, Simon J.; Coles, Simon J.; Horton, Peter N.; Hughes, David L.; Hursthouse, Michael B.; Light, Mark E.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 16
• Pages of publication: 3837
• a: 8.9718 ± 0.001 Å
• b: 10.7059 ± 0.0014 Å
• c: 12.7667 ± 0.001 Å
• α: 95.767 ± 0.009°
• β: 96.916 ± 0.008°
• γ: 91.488 ± 0.011°
• Cell volume: 1210.3 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.104
• Residual factor for significantly intense reflections: 0.0966
• Weighted residual factors for significantly intense reflections: 0.2525
• Weighted residual factors for all reflections included in the refinement: 0.2608
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No