Information card for entry 7223853

Structure parameters

• Formula: C38 H40 F4 Mn N2 O4
• Calculated formula: C38 H40 F4 Mn N2 O4
• Title of publication: On the stability of manganese tris(β-diketonate) complexes as redox mediators in DSSCs.
• Authors of publication: Carli, Stefano; Benazzi, Elisabetta; Casarin, Laura; Bernardi, Tatiana; Bertolasi, Valerio; Argazzi, Roberto; Caramori, Stefano; Bignozzi, Carlo Alberto
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 8
• Pages of publication: 5949 - 5956
• a: 18.2229 ± 0.0009 Å
• b: 19.0407 ± 0.001 Å
• c: 11.7031 ± 0.0007 Å
• α: 90°
• β: 115.785 ± 0.002°
• γ: 90°
• Cell volume: 3656.4 ± 0.3 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 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: 0.0998
• Residual factor for significantly intense reflections: 0.075
• Weighted residual factors for significantly intense reflections: 0.2065
• Weighted residual factors for all reflections included in the refinement: 0.231
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No