Abstract

A caesium lutetium(III) silicate, Cs3LuSi3O9, was synthesized by heating a pelletized mixture of Cs2CO3, Lu2O3 and SiO2 at 1273 K. Single crystals of the title compound were grown in a melted area of the pellet. Cs3LuSi3O9 is a single-chain silicate (ortho-rhom-bic space group Pna21) with a chain periodicity of six and is isostructural with Cs3 RE IIIGe3O9 (RE = Pr, Nd and Sm-Yb). The two symmetry-dependent [Si6O18]12- chains in the unit cell lie parallel to the [011] direction. The Lu3+ ions are octa-hedrally coordinated by O atoms of the silicate chains, generating a three-dimensional framework. Cs+ ions are located in the voids in the framework.

Highlights

  • Cs3LuSi3O9 is a sechser single-chain silicate, which crystallizes in the orthorhombic space group, Pna21

  • The Si—Obridge bond lengths in the title compound lie in the range 1.650 (4)–1.664 (4) A, and are slightly longer than the Si— Oterminal bond lengths [in the range 1.594 (4)–1.609 (4) A ; Table 1) and are in agreement with values found in other silicates

  • The angles Si1—Si2—Si3, Si2—Si3—Si1 and Si3—Si1—Si2 in the SiO4-linked zigzag chain in Cs3LuSi3O9 are 133.26 (7), 128.41 (7) and 134.64 (7), respectively. These values are larger than the angles observed in K6Lu2Si6O18, a sechser single-chain silicate with an Si1–Si2–Si3–Si3–Si2–Si1 sequence

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Summary

Chemical context

A lutetium(III) silicate, Lu2SiO5, containing the highest atomic weight rare-earth element, has been studied as the host crystal of a scintillator for radiation detection (Dorenbos et al, 1994; Melcher & Schweitzer, 1992). In other quaternary silicate systems containing alkali-metal (A) and rare-earth (RE) elements, a number of single-chain silicates have recently been reported: LiScSi2O6 (space groups C2/c, P21/c; Arlt & Angel, 2000; Redhammer & Roth, 2004), NaYSi2O6 (P21/c; Tobbens et al, 2005), NaTbSi2O6 (P21/c; Schafer et al, 2012), Na3YSi3O9 (P212121; Maksimov et al, 1980), Na3RESi3O9 (RE = Y, Dy, Gd, P212121; Shannon et al, 1980), Na3RESi3O9 (RE = Y, Er, P212121; Ananias et al, 2002), Na3TmSi3O9 (P212121; Kahlenberg et al, 2015), K3HoSi3O9 (Pm21n; Ponomarev et al, 1988), K3RESi3O9 (RE = Ho, Tm, Lu, Pm21n; Filipenko et al, 1988), K3TbSi3O9 (Pm21n; Kostova et al, 2007), and K2.9Rb0.1ErSi3O9 (P1; WierzbickaWieczorek et al, 2010). We report the synthesis and structural characterization of Cs3LuSi3O9, the first silicate found to be isostructural with the germanates

Structural commentary
Synthesis and crystallization
Refinement
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