Mc Kay Michael G, Friedrich Holger B, Maguire Glenn E M
School of Chemistry, University of KwaZulu-Natal, Durban 4041, South Africa.
Acta Crystallogr Sect E Struct Rep Online. 2007 Dec 6;64(Pt 1):o98. doi: 10.1107/S160053680705711X.
The title compound, C(68)H(64)O(8)·C(4)H(8)O(2), is a new resorcin-[4]arene cavitand synthetic precursor, obtained by alkyl-ation of a previously reported resorcin[4]arene. The additional alkyl bridges significantly rigidify the structure and enforce a 'bowl' shape on the mol-ecular cavity. In the crystal structure, the mol-ecule lies on a crystallographic mirror plane, and a single ethyl acetate mol-ecule (also lying on the mirror plane) is present within the compound cavity, illustrating the host capabilities of the mol-ecule.
标题化合物C(68)H(64)O(8)·C(4)H(8)O(2)是一种新型间苯二酚[4]芳烃穴状配体合成前体,通过对先前报道的间苯二酚[4]芳烃进行烷基化反应得到。额外的烷基桥显著增强了结构的刚性,并使分子腔呈现出“碗”状。在晶体结构中,分子位于一个晶体学镜面平面上,且在化合物腔内存在一个乙酸乙酯分子(也位于镜面上),这说明了该分子的主体容纳能力。