2-[9-(2-羟基苯基)-1,8-二氧代-1,2,3,4,5,6,7,8,9,10-十氢吖啶-10-基]乙酸的晶体结构
Crystal structure of 2-[9-(2-hy-droxy-phen-yl)-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-deca-hydro-acridin-10-yl]acetic acid.
作者信息
Akkurt Mehmet, Jasinski Jerry P, Mohamed Shaaban K, Allah Omyma A Abd, Tamam Asmaa H A, Albayati Mustafa R
机构信息
Department of Physics, Faculty of Sciences, Erciyes University, 38039 Kayseri, Turkey.
Department of Chemistry, Keene State College, 229 Main Street, Keene, NH 03435-2001, USA.
出版信息
Acta Crystallogr E Crystallogr Commun. 2015 Nov 21;71(Pt 12):o963-4. doi: 10.1107/S2056989015021611. eCollection 2015 Dec 1.
Abstract
The title compound, C21H21NO5, crystallizes with two mol-ecules in the asymmetric unit. In each mol-ecule, the central 1,4-di-hydro-pyridine ring adopts a shallow sofa conformations (with the C atom bearing the phenol ring as the flap), whereas the pendant cyclo-hexene rings both have twisted-boat conformations. Each mol-ecule features an intra-molecular O-H⋯O hydrogen bond, which closes an S(8) ring. In the crystal, the mol-ecules are linked by O-H⋯O, C-H⋯O and C-H⋯π inter-actions, forming a three-dimensional network.
摘要
标题化合物C21H21NO5在不对称单元中含有两个分子。在每个分子中，中心的1,4-二氢吡啶环呈浅沙发构象（以带有酚环的C原子为侧翼），而悬垂的环己烯环均呈扭船构象。每个分子都有一个分子内O—H⋯O氢键，形成一个S(8)环。在晶体中，分子通过O—H⋯O、C—H⋯O和C—H⋯π相互作用相连，形成三维网络。
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