Information card for entry 2207881

Structure parameters

• Chemical name: Bis(μ-4-methylpiperidine-1-dithiocarboxylato-κ^2^S:S')[bis(4- methylpiperidine-1-dithiocarboxylato-S:S')zinc(II)]
• Formula: C28 H48 N4 S8 Zn2
• Calculated formula: C28 H48 N4 S8 Zn2
• SMILES: S1[Zn]2([S]=C(N3CCC(CC3)C)S2)[S]=C(N2CCC(CC2)C)S[Zn]2([S]=C1N1CCC(CC1)C)[S]=C(N1CCC(CC1)C)S2
• Title of publication: Bis(μ-4-methylpiperidine-1-dithiocarboxylato-κ^2^<i>S</i>:<i>S</i>')[bis(4-methylpiperidine-1-dithiocarboxylato-<i>S</i>:<i>S</i>')zinc(II)]
• Authors of publication: Shaheen, Farkhanda; Gieck, Christine; Badshah, Amin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 1
• Pages of publication: m16 - m17
• a: 8.1806 ± 0.001 Å
• b: 11.4347 ± 0.0011 Å
• c: 11.9679 ± 0.0012 Å
• α: 108.808 ± 0.009°
• β: 107.28 ± 0.01°
• γ: 101.583 ± 0.009°
• Cell volume: 955.9 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0701
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.1097
• Weighted residual factors for all reflections included in the refinement: 0.1238
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes