Information card for entry 4314714

Structure parameters

• Formula: C12 H17 Cl Hg0.5 N O4 S2
• Calculated formula: C12 H17 Cl Hg0.5 N O4 S2
• Title of publication: Discrete Mercury(II) Complexes, One-Dimensional and Palladium(II)-Mediated Two-Dimensional Silver(I) Coordination Polymers of NS2-Macrocycle: Synthesis and Structural Characterization
• Authors of publication: Sunhong Park; So Young Lee; Shim Sung Lee
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 1238 - 1244
• a: 10.097 ± 0.001 Å
• b: 11.3304 ± 0.0011 Å
• c: 13.6241 ± 0.0013 Å
• α: 90°
• β: 94.29 ± 0.002°
• γ: 90°
• Cell volume: 1554.3 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0492
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0578
• Weighted residual factors for all reflections included in the refinement: 0.065
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No