Information card for entry 7026914

Structure parameters

• Formula: C68 H58 Cl2 Mn2 N8 O14
• Calculated formula: C68 H58 Cl2 Mn2 N8 O14
• Title of publication: A μ(1,1)- or μ(1,3)-carboxylate bridge makes the difference in the magnetic properties of dinuclear Mn(II) compounds.
• Authors of publication: Gómez, Verónica; Corbella, Montserrat; Font-Bardia, Mercé; Calvet, Teresa
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 48
• Pages of publication: 11664 - 11674
• a: 9.4995 ± 0.0003 Å
• b: 13.1136 ± 0.0004 Å
• c: 14.116 ± 0.0004 Å
• α: 111.089 ± 0.002°
• β: 95.032 ± 0.002°
• γ: 102.951 ± 0.002°
• Cell volume: 1571.31 ± 0.09 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: 0.0396
• Residual factor for significantly intense reflections: 0.0326
• Weighted residual factors for significantly intense reflections: 0.0788
• Weighted residual factors for all reflections included in the refinement: 0.0817
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No