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Two Crystal Structures of Ethylene and Acetylene Sorption Complexes of Dehydrated Fully $Ca^{2+}$-Exchanged Zeolite A

  • Jang, Se-Bok (Department of Chemistry, Pusan National University) ;
  • Moon, Sung-Doo (Pusan National University of Technology) ;
  • Park, Jong-Yul (Department of Chemistry, Pusan National University) ;
  • Kim, Un-Sik (Department of Chemistry, Pusan National University) ;
  • Kim, Yang (Department of Chemistry, Pusan National University)
  • Published : 1992.02.20

Abstract

Two crystal structures of ethylene (a= 12.272(2) ${\AA}$) and acetylene (a = 12.245(2) ${\AA}$) sorption complexes of dehydrated fully $Ca^{2+}$-exchanged zeolite A have been determined by single crystal X-ray diffraction techniques in the cubic space group, Pm3m at $21(1)^{\circ}C$. Their complexes were prepared by dehydration at $360^{\circ}C$ and $2{\times}10^{-6}$ Torr for 2 days, followed by exposure to 200 Torr of ethylene gas and 120 Torr of acetylene gas both at $24^{\circ}C$, respectively. The structures were refined to final R (weighted) indices of 0.062 with 209 reflections and 0.098 with 171 reflections, respectively, for which I > 3${\sigma}$(I). The structures indicate that all six $Ca^{2+}$ ions in the unit cell are associated with 6-oxygen ring of the aluminosilicate framework. Four of these extend somewhat into the large cavity where each is coordinated to three framework oxide ions and an ethylene molecule and/or an acetylene molecule. The carbon to carbon distance in ethylene sorption structure is 1.48(7) ${\AA}$ and that in acetylene sorption structure 1.25(8) ${\AA}$. The distances between $Ca^{2+}$ ion and carbon atom are 2.87(5) ${\AA}$ in ethylene sorption structure and 2.95(7) ${\AA}$ in acetylene sorption structure. These bonds are relatively weak and probably formed by the electrostatic attractions between the bivalent $Ca^{2+}$ ions and the polarizable ${\pi}$-electron density of the ethylene and/or acetylene molecule.

Keywords

References

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Cited by

  1. Crystal Structure of an Ethylene Sorption Complex of Fully Vacuum-Dehydrated Fully Ag+-Exchanged Zeolite X (FAU). Silver Atoms Have Reduced Ethylene To Give CH22- vol.109, pp.43, 1992, https://doi.org/10.1021/jp058185p