Information card for entry 2237778

Structure parameters

• Chemical name: Iodido{4-phenyl-1-[1-(1,3-thiazol-2-yl-κ<i>N</i>)ethylidene]thiosemicarbazidato-κ^2^<i>N'</i>,<i>S</i>}{4-phenyl-1-[1-(1,3-thiazol-2-yl)ethylidene]thiosemicarbazide-κ<i>S</i>}cadmium(II)
• Formula: C24 H23 Cd I N8 S4
• Calculated formula: C24 H23 Cd I N8 S4
• SMILES: [Cd]12(I)(SC(=N[N]2=C(c2scc[n]12)C)Nc1ccccc1)[S]=C(N/N=C(c1sccn1)/C)Nc1ccccc1
• Title of publication: Iodido{4-phenyl-1-[1-(1,3-thiazol-2-yl-κ<i>N</i>)ethylidene]thiosemicarbazidato-κ^2^<i>N</i>',<i>S</i>}{4-phenyl-1-[1-(1,3-thiazol-2-yl)ethylidene]thiosemicarbazide-κ<i>S</i>}cadmium(II)
• Authors of publication: Venkatraman, Ramaiyer; Samuel, Dasary S.; Arslan, Zikri; Hossain, Md. Alamgir; Fronczek, Frank R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 5
• Pages of publication: m246 - m247
• a: 8.6685 ± 0.0004 Å
• b: 10.1323 ± 0.0005 Å
• c: 16.722 ± 0.0008 Å
• α: 76.607 ± 0.002°
• β: 79.481 ± 0.002°
• γ: 77.91 ± 0.002°
• Cell volume: 1383.15 ± 0.12 ų
• Cell temperature: 90 ± 0.5 K
• Ambient diffraction temperature: 90 ± 0.5 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0385
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for significantly intense reflections: 0.0561
• Weighted residual factors for all reflections included in the refinement: 0.0597
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes