Information card for entry 8102361

Structure parameters

• Formula: C18 H18 N4 O8 S2 Zn
• Calculated formula: C18 H18 N4 O8 S2 Zn
• Title of publication: Crystal structure of tetraaqua-bis(2-(4-pyridyl)thiazole-4-carboxylate)zinc(II), Zn(H2O)4(C9H5O2N2S)2
• Authors of publication: Jian-Hua Qin; Ge Song; Wei Li
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2009
• Journal volume: 224
• Journal issue: 1
• Pages of publication: 151
• a: 6.302 ± 0.013 Å
• b: 6.962 ± 0.015 Å
• c: 12.71 ± 0.03 Å
• α: 103.22 ± 0.02°
• β: 95.21 ± 0.02°
• γ: 106.72 ± 0.02°
• Cell volume: 513 ± 2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.1018
• Residual factor for significantly intense reflections: 0.0954
• Weighted residual factors for significantly intense reflections: 0.2521
• Weighted residual factors for all reflections included in the refinement: 0.262
• Goodness-of-fit parameter for all reflections included in the refinement: 1.191
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No