Information card for entry 4309856

Structure parameters

• Formula: C4 H12 N2 S2 Zn
• Calculated formula: C4 H12 N2 S2 Zn
• SMILES: C1C[NH2][Zn]2(S1)[NH2]CCS2
• Title of publication: Cysteamine and Its Homoleptic Complexes with Group 12 Metal Ions. Differences in the Coordination Chemistry of ZnII, CdII, and HgII with a Small N,S-Donor Ligand
• Authors of publication: Holger Fleischer; Yvonne Dienes; Bernd Mathiasch; Volker Schmitt; Dieter Schollmeyer
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 8087 - 8096
• a: 18.2166 ± 0.0015 Å
• b: 4.9242 ± 0.0003 Å
• c: 10.0513 ± 0.0008 Å
• α: 90°
• β: 105.647 ± 0.004°
• γ: 90°
• Cell volume: 868.21 ± 0.11 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 all reflections: 0.0336
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0949
• Weighted residual factors for all reflections included in the refinement: 0.0957
• Goodness-of-fit parameter for all reflections included in the refinement: 1.156
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No