Information card for entry 1570810

Structure parameters

• Chemical name: Bis[1,3-bis(2,4,6-trimethylphenyl)imidazolium] bis(μ-<i>cis</i>-1,2-diphenylethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>':κ<i>S</i>)bis[(<i>cis</i>-1,2-diphenylethene-1,2-dithiolato-κ^2^<i>S</i>,<i>S</i>')iron(III)] dimethylformamide disolvate
• Formula: C52 H52 Fe N3 O S4
• Calculated formula: C52 H52 Fe N3 O S4
• Title of publication: Bis[1,3-bis(2,4,6-trimethylphenyl)imidazolium] bis(μ-cis-1,2-diphenylethene-1,2-dithiolato-κ2 S,S′:κS)bis[(cis-1,2-diphenylethene-1,2-dithiolato-κ2 S,S′)iron(III)] dimethylformamide disolvate
• Authors of publication: Selvakumar, Jayaraman; Arumugam, Kuppuswamy
• Journal of publication: IUCrData
• Year of publication: 2023
• Journal volume: 9
• Journal issue: 1
• a: 12.4019 ± 0.0014 Å
• b: 14.8205 ± 0.0019 Å
• c: 14.9762 ± 0.0018 Å
• α: 105.936 ± 0.004°
• β: 113.662 ± 0.003°
• γ: 94.486 ± 0.004°
• Cell volume: 2368.2 ± 0.5 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: 0.0431
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0803
• Weighted residual factors for all reflections included in the refinement: 0.0901
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0731
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No