Information card for entry 1514981

Structure parameters

• Formula: C47 H60 Co O9.75 Pt S4
• Calculated formula: C28 H22 Co O5 Pt S4
• Title of publication: Antiferromagnetic coupling across a tetrametallic unit through noncovalent interactions
• Authors of publication: Dahl, Eric W.; Baddour, Frederick G.; Fiedler, Stephanie R.; Hoffert, Wesley A.; Shores, Matthew P.; Yee, Gordon T.; Djukic, Jean-Pierre; Bacon, Jeffrey W.; Rheingold, Arnold L.; Doerrer, Linda H.
• Journal of publication: Chemical Science
• Year of publication: 2012
• Journal volume: 3
• Journal issue: 2
• Pages of publication: 602
• a: 22.814 ± 0.0008 Å
• b: 16.6711 ± 0.0007 Å
• c: 23.2989 ± 0.0014 Å
• α: 90°
• β: 92.135 ± 0.002°
• γ: 90°
• Cell volume: 8855.2 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0434
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0964
• Weighted residual factors for all reflections included in the refinement: 0.1003
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No