Information card for entry 7015859

Structure parameters

• Common name: (Cr4(tmp)2Cl6(Bz-iac)2).0.67(MeCN)
• Formula: C41.33 H50 Cl6 Cr4 N6.67 O6
• Calculated formula: C41.32 H49.98 Cl6 Cr4 N6.66 O6
• Title of publication: Chromium(iii) stars and butterflies: synthesis, structural and magnetic studies of tetrametallic clusters.
• Authors of publication: Batchelor, Luke J.; Sander, Mario; Tuna, Floriana; Helliwell, Madeleine; Moro, Fabrizio; van Slageren, Joris; Burzurí, Enrique; Montero, Oscar; Evangelisti, Marco; Luis, Fernando; McInnes, Eric J. L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 19
• Pages of publication: 5278 - 5284
• a: 23.3367 ± 0.0011 Å
• b: 23.3367 ± 0.0011 Å
• c: 23.501 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 11084 ± 1.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.1024
• Residual factor for significantly intense reflections: 0.0669
• Weighted residual factors for significantly intense reflections: 0.1811
• Weighted residual factors for all reflections included in the refinement: 0.1995
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No