Information card for entry 7035013

Structure parameters

• Formula: C16 H24 Cl2 N8 O8 S4 Zn
• Calculated formula: C16 H24 Cl2 N8 O8 S4 Zn
• Title of publication: Zinc(ii)-methimazole complexes: synthesis and reactivity.
• Authors of publication: Isaia, Francesco; Aragoni, Maria Carla; Arca, Massimiliano; Bettoschi, Alexandre; Caltagirone, Claudia; Castellano, Carlo; Demartin, Francesco; Lippolis, Vito; Pivetta, Tiziana; Valletta, Elisa
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 21
• Pages of publication: 9805 - 9814
• a: 12.3057 ± 0.0004 Å
• b: 12.3057 ± 0.0004 Å
• c: 20.5539 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3112.48 ± 0.18 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 7
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0434
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.1022
• Weighted residual factors for all reflections included in the refinement: 0.109
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No