Information card for entry 2203946

Structure parameters

• Chemical name: Bis[1,1'-bis(diphenylphosphino)ferrocenethiocyanatocopper(I)] dichloromethane disolvate
• Formula: C72 H60 Cl4 Cu2 Fe2 N2 P4 S2
• Calculated formula: C72 H60 Cl4 Cu2 Fe2 N2 P4 S2
• Title of publication: Di-μ-thiocyanato-bis{[1,1'-bis(diphenylphosphino)ferrocene-κ^2^<i>P</i>,<i>P</i>']copper(I)} dichloromethane disolvate
• Authors of publication: Li, Dan; Luo, Ya-Fang; Wu, Tao; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 7
• Pages of publication: m927 - m929
• a: 27.253 ± 0.002 Å
• b: 16.662 ± 0.001 Å
• c: 17.179 ± 0.001 Å
• α: 90°
• β: 114.429 ± 0.001°
• γ: 90°
• Cell volume: 7102.4 ± 0.8 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 8
• 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: 0.067
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for significantly intense reflections: 0.158
• Weighted residual factors for all reflections included in the refinement: 0.166
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes