Layered calcium hydrogen selenite chlorides Ca(HSeO3)Cl and Ca(HSeO3)Cl(H2O), the first halides obtained in СaCl2–H2SeO3–H2O system

Mishel R. Markovski 1 , Oleg I. Siidra 1 , 2 , Dmitri O. Charkin 3 , and Vasili Yu Grishaev 3
  • 1 Department of Crystallography, St. Petersburg State University, University Emb. 7/9, St. Petersburg, Russia
  • 2 Kola Science Center, Russian Academy of Sciences, Apatity, Murmansk Region, Russia
  • 3 Department of Chemistry, Moscow State University, Leninskie Gory 1, Moscow, Russia
Mishel R. Markovski
  • Department of Crystallography, St. Petersburg State University, University Emb. 7/9, St. Petersburg, Russia
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, Oleg I. Siidra
  • Corresponding author
  • Department of Crystallography, St. Petersburg State University, University Emb. 7/9, St. Petersburg, Russia
  • Kola Science Center, Russian Academy of Sciences, Apatity, Murmansk Region, Russia
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, Dmitri O. Charkin
  • Department of Chemistry, Moscow State University, Leninskie Gory 1, Moscow, Russia
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and Vasili Yu Grishaev
  • Department of Chemistry, Moscow State University, Leninskie Gory 1, Moscow, Russia
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Abstract

Synthesis, crystal structures and IR spectra of the first representatives of calcium hydrogen selenite halides are reported. Colourless prismatic crystals of calcium hydrogen selenite chloride Ca(HSeO3)Cl and corresponding hydrated analogue Ca(HSeO3)Cl(H2O) were produced upon evaporation of aqueous solutions. Ca(HSeO3)Cl is monoclinic, P21/c, a = 7.0031(11) Å, b = 7.7336(12) Å, c = 8.5024(13) Å, β = 109.889(3)°, V = 433.02(12) Å3, R1 = 0.039. Ca(HSeO3)Cl(H2O) is orthorhombic, Pbca, a = 6.222(4) Å, b = 10.413(7) Å, c = 16.875(10) Å, V = 1093.3 (12) Å3, R1 = 0.041. Ca(HSeO3)Cl and Ca(HSeO3)Cl(H2O) represent new structure types. In both structures, Ca2+ cations adopt mixed-ligand environments formed by oxygen atoms of hydrogen selenite anions (and water molecules for Ca(HSeO3)Cl(H2O)) and chloride ions. Both structures are layered. The crystal structure of Ca(HSeO3)Cl(H2O) demonstrates a rare phenomenon of hydrogen-bonded assembly of water and chloride in the interlayer space.

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