Information card for entry 7054328

Structure parameters

• Formula: C16 H18 Hg N4 S4
• Calculated formula: C16 H18 Hg N4 S4
• Title of publication: Effect of pyridyl substituents leading to the formation of green luminescent mercury(ii) coordination polymers, zinc(ii) dimers and a monomer
• Authors of publication: Singh, Vikram; Kumar, Vinod; Gupta, Ajit N.; Drew, Michael G. B.; Singh, Nanhai
• Journal of publication: New Journal of Chemistry
• Year of publication: 2014
• Journal volume: 38
• Journal issue: 8
• Pages of publication: 3737
• a: 9.4813 ± 0.0007 Å
• b: 9.88 ± 0.0007 Å
• c: 11.0632 ± 0.001 Å
• α: 92.892 ± 0.006°
• β: 95.604 ± 0.007°
• γ: 109.777 ± 0.006°
• Cell volume: 966.69 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0726
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.0967
• Weighted residual factors for all reflections included in the refinement: 0.1073
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7054220
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No