Information card for entry 7713063

Structure parameters

• Formula: C85 H153 Cr7 F8 N2 O32 Zn
• Calculated formula: C85 H153 Cr7 F8 N2 O32 Zn
• Title of publication: Synthesis and characterization of heterometallic rings templated through alkylammonium or imidazolium cations.
• Authors of publication: Alotaibi, Rajeh; Booth, Amy; Little, Edmund; Brookfield, Adam; Achari, Amritroop; Lockyer, Selena J.; Timco, Grigore A.; Whitehead, George F. S.; Vitórica-Yrezábal, Iñigo J; Chilton, Nicholas F.; Nair, Rahul R.; Collison, David; Winpenny, Richard E. P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• a: 34.9561 ± 0.0007 Å
• b: 16.6364 ± 0.0002 Å
• c: 44.4145 ± 0.0009 Å
• α: 90°
• β: 111.673 ± 0.002°
• γ: 90°
• Cell volume: 24003 ± 0.8 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0573
• Residual factor for significantly intense reflections: 0.0423
• Weighted residual factors for significantly intense reflections: 0.095
• Weighted residual factors for all reflections included in the refinement: 0.1003
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No