Information card for entry 2201956

Structure parameters

• Common name: Undecacarbonyl(μ~4~-2-thiodithiobenzoato- κ^4^C,S,S',S'')(trimethylphosphite)tetrafer
• Formula: C21 H13 Fe4 O14 P S3
• Calculated formula: C21 H13 Fe4 O14 P S3
• Title of publication: Undecacarbonyl(μ~4~-2-thiodithiobenzoato-κ^4^C,<i>S,S</i>',<i>S</i>'')(trimethylphosphite)tetrafer
• Authors of publication: Laifa El Adoui; Nourredine Benali-Cherif; Hocine Merazig
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 3
• Pages of publication: m108 - m110
• a: 9.263 ± 0.005 Å
• b: 11.588 ± 0.005 Å
• c: 15.784 ± 0.003 Å
• α: 93.971 ± 0.002°
• β: 100.923 ± 0.005°
• γ: 111.959 ± 0.005°
• Cell volume: 1524.5 ± 1.1 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 ± 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: 0.0477
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0925
• Weighted residual factors for all reflections included in the refinement: 0.0969
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes