Information card for entry 7223900

Structure parameters

• Formula: C22 H14 Hg N6 S2
• Calculated formula: C22 H14 Hg N6 S2
• Title of publication: Amalgamating 4'-substituted 4,2':6',4''-terpyridine ligands with double-helical chains or ladder-like networks
• Authors of publication: Zhang, Guoqi; Tan, Jiawen; Phoenix, Tonya; Manke, David; Golen, James A.; Rheingold, Arnold L.
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 7.195 ± 0.003 Å
• b: 27.428 ± 0.009 Å
• c: 10.889 ± 0.004 Å
• α: 90°
• β: 107.89 ± 0.007°
• γ: 90°
• Cell volume: 2045 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0755
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for significantly intense reflections: 0.1307
• Weighted residual factors for all reflections included in the refinement: 0.1391
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No