Information card for entry 2242385

Structure parameters

• Common name: Fe4NiS6
• Chemical name: Decacarbonyl(μ~3~-3,7-dithianonane-1,9-dithiolato)bis(μ~2~-propane-1,3-dithiolato)nickel(II)tetrairon(II) dichloromethane disolvate
• Formula: C25 H30 Cl4 Fe4 Ni O10 S8
• Calculated formula: C25 H30 Cl4 Fe4 Ni O10 S8
• Title of publication: Synthesis and crystal structure of decacarbonyl(μ~3~-3,7-dithianonane-1,9-dithiolato)bis(μ~2~-propane-1,3-dithiolato)nickel(II)tetrairon(II) dichloromethane disolvate
• Authors of publication: Ren, Gan; Sang, Ge
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 3
• Pages of publication: 328 - 331
• a: 12.434 ± 0.0008 Å
• b: 13.9981 ± 0.001 Å
• c: 14.4912 ± 0.0009 Å
• α: 77.86 ± 0.004°
• β: 67.57 ± 0.004°
• γ: 64.036 ± 0.004°
• Cell volume: 2093.3 ± 0.3 ų
• Cell temperature: 243 ± 2 K
• Ambient diffraction temperature: 243 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0445
• Residual factor for significantly intense reflections: 0.0319
• Weighted residual factors for significantly intense reflections: 0.0685
• Weighted residual factors for all reflections included in the refinement: 0.0751
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes