Crystal and molecular structure of tris-(O-isopropylxanthato)-chromium(III) |
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Authors: | Sanjeev Bhargava Rakesh Bohra R C Mehrotra |
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Institution: | (1) Department of Chemistry, University of Rajasthan, 302004 Jaipur, India |
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Abstract: | The title compound has been synthesized by the reaction of CrCl36H2O with K{S2COCH(CH3)2} in a 13 molar ratio in an aqueous medium. It has been characterized by elemental analysis and IR spectral studies. Crystals of Cr{S2COCH(CH3)2}3 are monoclinic, space group P21/n witha=10.002(2),b=10.973(1),c=18.961(6) Å,=91.78(2)°,V=2079.9 Å3,Z=4,D
calc=1.46 g cm–3, monochromatic radiation (Mo-K), =0.71069 Å,=11.2 cm–1,F(0 0 0)=948,T=295K, finalR=0.0320 for 2641 reflections. The environment of the chromium atom is based on an octahedral geometry having six sulfur donor atoms from three symmetrically chelated ligands with average distances: Cr-S=2.396(9) Å, C-S=1.690(3) Å and C-O=1.315(3) Å. The bond distance between oxygen atom and the carbon atom of the isopropyl group (O-Cav=1.478(4) Å) suggests that the form –S
2
(–)
C=O(+)CH(CH3)2 contributes significantly to the structure of the isopropyl group. |
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