| 三环已基锡L-扁桃酸酯配合物的合成、结构及性质 |
| |
| 引用本文： | 张复兴,邝代治,冯泳兰,王剑秋,蒋伍玖,庾江喜,朱小明. 三环已基锡L-扁桃酸酯配合物的合成、结构及性质[J]. 应用化学, 2015, 32(10): 1120-1126. DOI: 10.11944/j.issn.1000-0518.2015.10.150055 |
| |
| 作者姓名： | 张复兴 邝代治 冯泳兰 王剑秋 蒋伍玖 庾江喜 朱小明 |
| |
| 作者单位： | 衡阳师范学院化学与材料科学系,功能金属有机材料湖南省普通高等学校重点实验室 湖南 衡阳 421008 |
| |
| 基金项目： | 湖南省高校创新平台开放基金项目(15K107)、湖南省自然科学基金项目(11JJ3021)、湖南省重点学科基金、湖南省高校科技创新团队支持计划和湖南省高校重点实验室开放基金资助 |
| |
| 摘 要： | 三环己基氢氧化锡与L-扁桃酸(物质的量比1:1)在苯和乙醇混合溶剂中反应合成了三环己基锡L-扁桃酸酯。 经X射线衍射方法测定了其晶体结构,配合物属斜方晶系,空间群为P212121,晶体学参数a=0.80825(4) nm,b=1.77151(8) nm,c=1.8385(2) nm,α=β=γ=90°,V=2.6324(2) nm3,Z=4,Dc=1.310 g/nm3,μ(MoKα)=9.92 cm-1,F(000)=1080,R1=0.0472,wR2=0.1341。 中心锡原子与环己基碳原子和氧原子构成畸型四面体。 对其结构进行量子化学从头计算,探讨了配合物的稳定性、分子轨道能量以及一些前沿分子轨道的组成特征。 研究了配合物的热稳定性、电化学性能、圆二色谱和体外抗癌活性。
|
| 关 键 词： | 三环己基锡L-扁桃酸酯 合成 结构 抗癌活性 |
| 收稿时间： | 2015-02-05 |
Synthesis,Structure and Properties of Tricyclohexyltin L-Mandeliate |
| |
| ZHANG Fuxing,KUANG Daizhi,FENG Yonglan,WANG Jianqiu,YU Jiangxi,JIANG Wujiu,ZHU Xiaoming. Synthesis,Structure and Properties of Tricyclohexyltin L-Mandeliate[J]. Chinese Journal of Applied Chemistry, 2015, 32(10): 1120-1126. DOI: 10.11944/j.issn.1000-0518.2015.10.150055 |
| |
| Authors: | ZHANG Fuxing KUANG Daizhi FENG Yonglan WANG Jianqiu YU Jiangxi JIANG Wujiu ZHU Xiaoming |
| |
| Affiliation: | Department of Chemistry and Material Science,Hengyang Normal University,Key Laboratory of Functional Organometallic Materials of Hengyang Normal University,College of Hu'nan Province,Hengyang,Hu'nan 421008,China |
| |
| Abstract: | Tricyclohexyltin L-mandeliate was synthesized by the reaction of tricyclohexyltin hydroxide with L-mandelic acid. Its structure has been determined by X-ray single crystal diffraction. The crystal is orthorhombic with space group P212121, a=0.80825(4) nm, b=1.77151(8) nm, c=1.8385(2) nm, α=β=γ=90°, V=2.6324(2) nm3, Z=4, Dc=1.310 g/nm3, μ(MoKα)=9.92 cm-1, F(000)=1080, R1=0.0472, wR2=0.1341. The tin atom has a distorted tetrahedral geometry. The stability of tricyclohexyltin L-mandeliate, its orbital energies and composition characteristics of some frontier molecular orbitals have been investigated by quantum chemistry calculation by means of G03W package and taking Lanl2dz basis set. Further more, thermal stability, electrochemical property, CD spectrum and anticancer activity of tricyclohexyltin L-mandeliate were also tested. |
| |
| Keywords: | tricyclohexyltin L-mandeliate synthesis structure antitumor activity |
|
| 点击此处可从《应用化学》浏览原始摘要信息 |
|
点击此处可从《应用化学》下载全文 |
|
