Information card for entry 4347565

Structure parameters

• Formula: C24 H50 Fe2 N4 O2 S2 Si4
• Calculated formula: C24 H50 Fe2 N4 O2 S2 Si4
• SMILES: C[Si](C)(N([Fe]12([n]3ccc(OC)cc3)S[Fe]2(N([Si](C)(C)C)[Si](C)(C)C)([n]2ccc(OC)cc2)S1)[Si](C)(C)C)C
• Title of publication: Interconversion between [Fe4S4] and [Fe2S2] Clusters Bearing Amide Ligands.
• Authors of publication: Tanifuji, Kazuki; Tajima, Shunichi; Ohki, Yasuhiro; Tatsumi, Kazuyuki
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 9
• Pages of publication: 4512 - 4518
• a: 22.876 ± 0.007 Å
• b: 11.048 ± 0.003 Å
• c: 14.488 ± 0.004 Å
• α: 90°
• β: 92.495 ± 0.004°
• γ: 90°
• Cell volume: 3658.1 ± 1.8 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for all reflections included in the refinement: 0.1075
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No