Information card for entry 2200069

Structure parameters

• Chemical name: Bis(μ-N-ethyl-N-isopropyldithiocarbamato-S:S')- bis[(N-ethyl-N-isopropyldithiocarbamato-S,S')zinc(II)]
• Formula: C24 H48 N4 S8 Zn2
• Calculated formula: C24 H48 N4 S8 Zn2
• SMILES: C1(N(CC)C(C)C)=[S][Zn]23(S1)[S]=C(N(CC)C(C)C)[S]2[Zn]12([S]=C(N(CC)C(C)C)S1)[S]=C(N(CC)C(C)C)[S]32
• Title of publication: Bis(μ-<i>N</i>-ethyl-<i>N</i>-isopropyldithiocarbamato-<i>S</i>:<i>S</i>')bis[(<i>N</i>-ethyl-<i>N</i>-isopropyldithiocarbamato-<i>S</i>,<i>S</i>')zinc(II)]
• Authors of publication: Baba, Ibrahim; Farina, Yang; Othman, A. Hamid; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 1
• Pages of publication: m51 - m52
• a: 10.8646 ± 0.0001 Å
• b: 15.0517 ± 0.0001 Å
• c: 11.2934 ± 0.0001 Å
• α: 90°
• β: 101.419 ± 0.001°
• γ: 90°
• Cell volume: 1810.26 ± 0.03 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.045
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for all reflections included in the refinement: 0.094
• Goodness-of-fit parameter for all reflections included in the refinement: 0.972
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes