Abstract

Single crystals of Cu2ZnSiS4, dicopper(I) zinc silicon tetrasulfide, have been prepared via high-temperature solid-state synthesis. Cu2ZnSiS4 was found to have the wurtz-stannite structure type, like that of Li2CdGeS4, Li2CdSnS4, and Cu2CdSiS4. Each sulfur anion is tetra­hedrally coordinated by two Cu cations, one Si cation, and one Zn cation, forming a three-dimensional honeycomb structure. When viewed along the c axis, the atoms are aligned in rows in which each cation alternates with the sulfur anions.

Highlights

  • Single crystals of Cu2ZnSiS4, dicopper(I) zinc silicon tetrasulfide, have been prepared via high-temperature solid-state synthesis

  • Each sulfur anion is tetrahedrally coordinated by two Cu cations, one Si cation, and one Zn cation, forming a three-dimensional honeycomb structure

  • When viewed along the c axis, the atoms are aligned in rows in which each cation alternates with the sulfur anions

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Summary

Structure Reports

Single crystals of Cu2ZnSiS4, dicopper(I) zinc silicon tetrasulfide, have been prepared via high-temperature solid-state synthesis. Cu2ZnSiS4 was found to have the wurtz-stannite structure type, like that of Li2CdGeS4, Li2CdSnS4, and. Each sulfur anion is tetrahedrally coordinated by two Cu cations, one Si cation, and one Zn cation, forming a three-dimensional honeycomb structure. When viewed along the c axis, the atoms are aligned in rows in which each cation alternates with the sulfur anions. Data collection: SMART (Bruker, 1998); cell refinement: SAINT (Bruker, 1998); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008); molecular graphics: CrystalMaker (Palmer, 2010); software used to prepare material for publication: publCIF (Westrip, 2010)

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