Information card for entry 2228063

Structure parameters

• Chemical name: Dicyanidobis(<i>N</i>,<i>N</i>'-dimethythiourea-κ<i>S</i>)mercury(II)
• Formula: C8 H16 Hg N6 S2
• Calculated formula: C8 H16 Hg N6 S2
• SMILES: C(#N)[Hg](C#N)([S]=C(NC)NC)[S]=C(NC)NC
• Title of publication: Dicyanidobis(<i>N</i>,<i>N</i>'-dimethythiourea-κ<i>S</i>)mercury(II)
• Authors of publication: Riaz Malik, Muhammad; Ali, Saqib; Ahmad, Saeed; Altaf, Muhammad; Stoeckli-Evans, Helen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 9
• Pages of publication: m1060 - m1061
• a: 18.1161 ± 0.0011 Å
• b: 7.7533 ± 0.0005 Å
• c: 14.0553 ± 0.0008 Å
• α: 90°
• β: 128.533 ± 0.003°
• γ: 90°
• Cell volume: 1544.32 ± 0.17 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0178
• Residual factor for significantly intense reflections: 0.0168
• Weighted residual factors for significantly intense reflections: 0.0359
• Weighted residual factors for all reflections included in the refinement: 0.0361
• Goodness-of-fit parameter for all reflections included in the refinement: 1.141
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes