Information card for entry 7044010

Structure parameters

• Common name: Zinc cyclam tetrafluoroborate
• Chemical name: [Zn(cyclam)(2MeCN)](BF4)2
• Formula: C14 H30 B2 F8 N6 Zn
• Calculated formula: C14 H30 B2 F8 N6 Zn
• Title of publication: Chelated [Zn(cyclam)]2+ Lewis Acid Improves the Reactivity of the Electrochemical Reduction of CO2 by Mn Catalysts with Bulky Bipyridine Ligands
• Authors of publication: Zhanaidarova, Almagul; Steger, Han; Reineke, Mark H.; Kubiak, Clifford P.
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 17.4835 ± 0.0005 Å
• b: 7.9463 ± 0.0002 Å
• c: 18.0503 ± 0.0005 Å
• α: 90°
• β: 114.592 ± 0.001°
• γ: 90°
• Cell volume: 2280.25 ± 0.11 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.0325
• Residual factor for significantly intense reflections: 0.0297
• Weighted residual factors for significantly intense reflections: 0.076
• Weighted residual factors for all reflections included in the refinement: 0.0781
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No