Information card for entry 2231278

Structure parameters

• Chemical name: Bis(<i>O</i>-<i>n</i>-butyl dithiocarbonato-κ^2^<i>S</i>,<i>S</i>')bis(pyridine-κ<i>N</i>)manganese(II)
• Formula: C20 H28 Mn N2 O2 S4
• Calculated formula: C20 H28 Mn N2 O2 S4
• Title of publication: Bis(<i>O</i>-<i>n</i>-butyl dithiocarbonato-κ^2^<i>S</i>,<i>S</i>')bis(pyridine-κ<i>N</i>)manganese(II)
• Authors of publication: Alam, Naveed; Ehsan, Muhammad Ali; Zeller, Matthias; Mazhar, Muhammad; Arifin, Zainudin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: m1064
• a: 10.9189 ± 0.0017 Å
• b: 6.0853 ± 0.0009 Å
• c: 17.65 ± 0.003 Å
• α: 90°
• β: 97.536 ± 0.003°
• γ: 90°
• Cell volume: 1162.6 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0255
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.0636
• Weighted residual factors for all reflections included in the refinement: 0.0639
• Goodness-of-fit parameter for all reflections included in the refinement: 1.122
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes