Information card for entry 2226014

Structure parameters

• Chemical name: di-μ-sulfido-bis{[(2<i>R</i>)-2-acetoxy-2-aminoethane-1-thiolato- κ^2^<i>N</i>,<i>S</i>]oxidomolybdenum(V)}
• Formula: C8 H16 Mo2 N2 O6 S4
• Calculated formula: C8 H16 Mo2 N2 O6 S4
• SMILES: [Mo]123([Mo]4(S1)(S2)(SC[C@H]([NH2]4)C(=O)OC)=O)(SC[C@H]([NH2]3)C(=O)OC)=O
• Title of publication: Redetermination of di-μ-sulfido-bis{[(2<i>R</i>)-2-acetoxy-2-aminoethane-1-thiolato-κ^2^<i>N</i>,<i>S</i>]oxidomolybdenum(V)}
• Authors of publication: Akashi, Haruo; Shiraga, Yuji; Shibahara, Takashi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 5
• Pages of publication: m573
• a: 9.195 ± 0.005 Å
• b: 5.622 ± 0.003 Å
• c: 17.437 ± 0.009 Å
• α: 90°
• β: 91.6763 ± 0.0015°
• γ: 90°
• Cell volume: 901 ± 0.8 ų
• Cell temperature: 93.3 K
• Ambient diffraction temperature: 93.3 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.0236
• Weighted residual factors for all reflections included in the refinement: 0.0674
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes