Information card for entry 7114212

Structure parameters

• Formula: C88 H128 Cu12 K2 N6 O58
• Calculated formula: C88 H72 Cu12 K2 N6 O58
• Title of publication: Engineering of ferrimagnetic Cu12-cluster arrays through supramolecular interactionsElectronic supplementary information (ESI) available: χT vs. T plot for K+ salt 1b at magnetic fields of 1 and 10 kOe. See http://www.rsc.org/suppdata/cc/b2/b201585b/
• Authors of publication: Murugesu, Muralee; Anson, Christopher E.; Powell, Annie K.
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 10
• Pages of publication: 1054
• a: 12.2497 ± 0.0006 Å
• b: 32.628 ± 0.003 Å
• c: 14.5421 ± 0.0009 Å
• α: 90°
• β: 92.655 ± 0.007°
• γ: 90°
• Cell volume: 5806 ± 0.7 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0461
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for significantly intense reflections: 0.0921
• Weighted residual factors for all reflections included in the refinement: 0.0955
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No