Information card for entry 2224018

Structure parameters

• Chemical name: Bis(benzenethiolato)(2,2'-biquinoline)zinc(II)
• Formula: C30 H22 N2 S2 Zn
• Calculated formula: C30 H22 N2 S2 Zn
• SMILES: c1cccc2[n]3[Zn](Sc4ccccc4)([n]4c(c3ccc12)ccc1ccccc41)Sc1ccccc1
• Title of publication: Bis(benzenethiolato)(2,2'-biquinoline)zinc(II)
• Authors of publication: Monroe, Thomas Blake; Ikonen, Anita; Maner, Jonathon A.; Jones, Daniel S.; Striplin, Durwin R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 11
• Pages of publication: m1421
• a: 17.141 ± 0.002 Å
• b: 11.5591 ± 0.0008 Å
• c: 12.8318 ± 0.0014 Å
• α: 90°
• β: 93.811 ± 0.01°
• γ: 90°
• Cell volume: 2536.8 ± 0.4 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for all reflections included in the refinement: 0.0759
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes