Information card for entry 7008089

Structure parameters

• Formula: C66 H67 Fe4 N4 O1.5 S8 Zn2
• Calculated formula: C66 H60 Fe4 N4 O1.5 S8 Zn2
• Title of publication: Ditopic redox-active polyferrocenyl zinc(II) dithiocarbamate macrocyclic receptors: synthesis, coordination and electrochemical recognition properties.
• Authors of publication: Wong, Wallace W. H.; Curiel, David; Lai, Siu-Wai; Drew, Michael G. B.; Beer, Paul D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 4
• Pages of publication: 774 - 781
• a: 15.302 ± 0.02 Å
• b: 30.255 ± 0.034 Å
• c: 32.342 ± 0.037 Å
• α: 90°
• β: 102.577 ± 0.01°
• γ: 90°
• Cell volume: 14614 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.1977
• Residual factor for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections: 0.334
• Weighted residual factors for significantly intense reflections: 0.2843
• Goodness-of-fit parameter for all reflections: 1.08
• Goodness-of-fit parameter for significantly intense reflections: 1.326
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No