Information card for entry 7017390

Structure parameters

• Formula: C38 H24 Cl2 Mn2 N6 O11
• Calculated formula: C38 H24 Cl2 Mn2 N6 O11
• Title of publication: Magneto-structural correlations in dinuclear Mn(iii) compounds with formula [{Mn(L)(NN)}(μ-O)(μ-2-RC(6)H(4)COO)(2){Mn(L')(NN)}](n+).
• Authors of publication: Gómez, Verónica; Corbella, Montserrat; Roubeau, Olivier; Teat, Simon J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 44
• Pages of publication: 11968 - 11975
• a: 33.849 ± 0.007 Å
• b: 25.673 ± 0.006 Å
• c: 12.6 ± 0.003 Å
• α: 90°
• β: 108.432 ± 0.003°
• γ: 90°
• Cell volume: 10388 ± 4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0858
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.1329
• Weighted residual factors for all reflections included in the refinement: 0.145
• Goodness-of-fit parameter for all reflections included in the refinement: 0.92
• Diffraction radiation wavelength: 0.7749 Å
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No