Information card for entry 2223074

Structure parameters

• Chemical name: Bis(2-cyclohexyliminomethyl-4,6-disulfanylphenolato)zinc(II)
• Formula: C26 H32 N2 O2 S4 Zn
• Calculated formula: C26 H32 N2 O2 S4 Zn
• SMILES: c12c(c(cc(c1)S)S)O[Zn]1([N](C3CCCCC3)=Cc3c(c(cc(c3)S)S)O1)[N](=C2)C1CCCCC1
• Title of publication: Bis(2-cyclohexyliminomethyl-4,6-disulfanylphenolato)zinc(II)
• Authors of publication: Chen, Wu; Xu, Di; Liu, Lian; Zeng, Qing-Fu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 9
• Pages of publication: m1089
• a: 15.031 ± 0.004 Å
• b: 12.663 ± 0.003 Å
• c: 14.182 ± 0.004 Å
• α: 90°
• β: 91.735 ± 0.015°
• γ: 90°
• Cell volume: 2698.1 ± 1.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0558
• Residual factor for significantly intense reflections: 0.0451
• Weighted residual factors for significantly intense reflections: 0.1322
• Weighted residual factors for all reflections included in the refinement: 0.1411
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes