Information card for entry 2224349

Structure parameters

• Chemical name: <i>trans</i>-Bis(μ-2-hydroxyethanethiolato- κ^2^<i>S</i>:<i>S</i>)bis[dinitrosyliron(II)](<i>Fe</i>—<i>Fe</i>)
• Formula: C4 H10 Fe2 N4 O6 S2
• Calculated formula: C4 H10 Fe2 N4 O6 S2
• SMILES: C(CO)[S]1[Fe]2(N=O)(N=O)[S](CCO)[Fe]12(N=O)N=O
• Title of publication: <i>trans</i>-Bis(μ-2-hydroxyethanethiolato-κ^2^<i>S</i>:<i>S</i>)bis[dinitrosyliron(II)](<i>Fe</i>—<i>Fe</i>)
• Authors of publication: Lee, Hon Man; Chiou, Show-Jen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: m1600
• a: 16.943 ± 0.003 Å
• b: 5.007 ± 0.0007 Å
• c: 14.931 ± 0.002 Å
• α: 90°
• β: 94.327 ± 0.003°
• γ: 90°
• Cell volume: 1263 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.0441
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.0571
• Weighted residual factors for all reflections included in the refinement: 0.0612
• Goodness-of-fit parameter for all reflections included in the refinement: 0.943
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes