Information card for entry 2018333

Structure parameters

• Chemical name: <i>rac</i>-pentaaqua-1κ^5^<i>O</i>-(μ-2-sulfidoacetato- 1:2κ^3^<i>O</i>:<i>O</i>',<i>S</i>)bis(2-sulfidoacetato- 2κ^2^<i>O</i>,<i>S</i>)manganese(II)tin(IV)
• Formula: C6 H16 Mn O11 S3 Sn
• Calculated formula: C6 H16 Mn O11 S3 Sn
• SMILES: [Sn]123(SCC(=[O]1)O[Mn]([OH2])([OH2])([OH2])([OH2])[OH2])(SCC(=O)O2)SCC(=O)O3
• Title of publication: A novel heterometallic dinuclear compound: <i>rac</i>-pentaaqua-1κ^5^<i>O</i>-(μ-2-sulfidoacetato-1:2κ^3^<i>O</i>:<i>O</i>',<i>S</i>)bis(2-sulfidoacetato-2κ^2^<i>O</i>,<i>S</i>)manganese(II)tin(IV)
• Authors of publication: Song, Li; Ling, Chun; Wang, Xinping
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: m384 - m386
• a: 9.8901 ± 0.0014 Å
• b: 10.4992 ± 0.0014 Å
• c: 15.883 ± 0.002 Å
• α: 90°
• β: 96.631 ± 0.002°
• γ: 90°
• Cell volume: 1638.2 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0199
• Residual factor for significantly intense reflections: 0.0183
• Weighted residual factors for significantly intense reflections: 0.0428
• Weighted residual factors for all reflections included in the refinement: 0.0438
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes