Information card for entry 7015856

Structure parameters

• Common name: [Cr4(tmp)2(t-bu-bpy)3Cl6],4MeCN,0.5Me2CO,0.5H2O
• Formula: C75.5 H110 Cl6 Cr4 N10 O7
• Calculated formula: C75.5 H109 Cl6 Cr4 N10 O7
• 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: 13.9679 ± 0.0009 Å
• b: 19.2804 ± 0.0012 Å
• c: 19.5271 ± 0.0017 Å
• α: 60.485 ± 0.001°
• β: 74.53 ± 0.001°
• γ: 74.95 ± 0.001°
• Cell volume: 4358.7 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0583
• Residual factor for significantly intense reflections: 0.0495
• Weighted residual factors for significantly intense reflections: 0.143
• Weighted residual factors for all reflections included in the refinement: 0.1496
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No