Information card for entry 7046485

Structure parameters

• Formula: C12 H27 Cl3 Cr2 N2 O6
• Calculated formula: C12 H27 Cl3 Cr2 N2 O6
• Title of publication: A simple methodology for constructing ferromagnetically coupled Cr(iii) compounds.
• Authors of publication: Fraser, Hector W. L.; Smythe, Lucy; Dey, Sourav; Nichol, Gary S.; Piligkos, Stergios; Rajaraman, Gopalan; Brechin, Euan K.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 24
• Pages of publication: 8100 - 8109
• a: 7.10996 ± 0.00016 Å
• b: 10.2978 ± 0.0002 Å
• c: 13.8317 ± 0.0003 Å
• α: 90°
• β: 103.201 ± 0.002°
• γ: 90°
• Cell volume: 985.95 ± 0.04 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0302
• Residual factor for significantly intense reflections: 0.0274
• Weighted residual factors for significantly intense reflections: 0.0564
• Weighted residual factors for all reflections included in the refinement: 0.0582
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No