Crystal structure of p-xylene@silicalite-1

对二甲苯@硅沸石-1的晶体结构

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Abstract

The crystal structure of a highly loaded complex of silicalite-1 (SL-1) with eight mol-ecules of p-xylene per unit cell has been solved by single-crystal X-ray diffraction. In the crystal, four symmetrical Si(24)O(48)·2C(8)H(10) subunits per unit cell are observed. The p-xylene mol-ecules sit at two different positions within the SL-1 channels. The first mol-ecule is located at the inter-section of the sinusoidal and straight channels, while the second guest mol-ecule is positioned in the center of the double ten-membered ring (10-MR) of the sinusoidal channel.

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