Information card for entry 4075491

Structure parameters

• Formula: C30 H26 F10 N2 Zn
• Calculated formula: C30 H26 F10 N2 Zn
• SMILES: c1(c(c(c(c(c1F)F)F)F)F)[Zn]([N](C)(C)Cc1ccccc1)(c1c(c(c(c(c1F)F)F)F)F)[N](C)(C)Cc1ccccc1
• 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: 22.8942 ± 0.0006 Å
• b: 8.7771 ± 0.0002 Å
• c: 16.1559 ± 0.0003 Å
• α: 90°
• β: 118.437 ± 0.001°
• γ: 90°
• Cell volume: 2854.73 ± 0.12 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0317
• Residual factor for significantly intense reflections: 0.0294
• Weighted residual factors for significantly intense reflections: 0.0756
• Weighted residual factors for all reflections included in the refinement: 0.0772
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No