Information card for entry 2223750

Structure parameters

• Chemical name: Tetraethylammonium hexacyanidoferrate(III) bis(diaqua{6,6'-dimethoxy-2,2'- [<i>o</i>-phenylenebis(nitrilomethylidyne)]diphenolato}manganese(III))‒ methanol‒ethanol (1/2/2)
• Formula: C64 H84 Fe Mn2 N11 O16
• Calculated formula: C64 H84 Fe Mn2 N11 O16
• Title of publication: Tetraethylammonium hexacyanidoferrate(III) bis(diaqua{6,6'-dimethoxy-2,2'-[<i>o</i>-phenylenebis(nitrilomethylidyne)]diphenolato}manganese(III))‒methanol‒ethanol (1/2/2)
• Authors of publication: Wang, Ting-Ting; Xie, Ji-Min
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 11
• Pages of publication: m1387 - m1388
• a: 24.83 ± 0.02 Å
• b: 12.467 ± 0.011 Å
• c: 22.915 ± 0.019 Å
• α: 90°
• β: 98.077 ± 0.012°
• γ: 90°
• Cell volume: 7023 ± 10 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1082
• Residual factor for significantly intense reflections: 0.0483
• Weighted residual factors for significantly intense reflections: 0.1043
• Weighted residual factors for all reflections included in the refinement: 0.1285
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes