Information card for entry 4318619

Structure parameters

• Formula: C40 H36 Fe N2 S2 Si2
• Calculated formula: C40 H36 Fe N2 S2 Si2
• SMILES: [Fe](S[Si](c1ccccc1)(c1ccccc1)c1ccccc1)(S[Si](c1ccccc1)(c1ccccc1)c1ccccc1)([N]#CC)[N]#CC
• Title of publication: Synthesis and Reactions of Triphenylsilanethiolato Complexes of Manganese(II), Iron(II), Cobalt(II), and Nickel(II)
• Authors of publication: Takashi Komuro; Hiroyuki Kawaguchi; Kazuyuki Tatsumi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 5083 - 5090
• a: 8.875 ± 0.002 Å
• b: 22.64 ± 0.01 Å
• c: 18.723 ± 0.004 Å
• α: 90°
• β: 91.12 ± 0.02°
• γ: 90°
• Cell volume: 3761 ± 2 ų
• Cell temperature: 193.2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for significantly intense reflections: 0.072
• Weighted residual factors for all reflections included in the refinement: 0.093
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No