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赖氨酸铜稳定常数的测定及优化计算
引用本文:杨云裳,关晓,张应鹏,陈宇涛.赖氨酸铜稳定常数的测定及优化计算[J].安徽农业科学,2010,38(27):15423-15425.
作者姓名:杨云裳  关晓  张应鹏  陈宇涛
作者单位:兰州理工大学石油化工学院,甘肃兰州,730050
摘    要:采用pH电位滴定法测定了铜离子与赖氨酸配合物在离子强度为0.1mol/L(NaCl)、温度为25℃时的pH值变化,用半整数作图法得出配合物的稳定常数为:1gK;=10.6,1gK:=8.5,1gK,=2.1。并运用量子化学密度泛函理论对产物的几何构型进行了优化,同时计算得到了热分解反应的标准热力学量变。

关 键 词:赖氨酸  金属配合物  pH电位滴定  稳定常数  量子化学计算

Determination and Quantizing Calculation of Stability Constant of Cu-lysine
YANG Yun-shang et al.Determination and Quantizing Calculation of Stability Constant of Cu-lysine[J].Journal of Anhui Agricultural Sciences,2010,38(27):15423-15425.
Authors:YANG Yun-shang
Institution:YANG Yun-shang et al(College of Petrochemical Processing,Lanzhou University of Technology,Lanzhou,Gansu 730050)
Abstract:The change of pH value of Cu2+-lysine complex solution with ionic strength at 0.1 mol/L(NaCl)and temperature at 25 ℃ was determined by using pH electric titration.The stability constants of the complex were obtained by using half-integer graphing method as follows:lgK1=10.6,lgK2=8.5 and lgK3=2.1 resp.The geometric configuration of product was optimized by applying quantum chemical density functional theory and the standard thermodynamics quantitative change of thermal decomposition reaction was calculated out simultaneously.
Keywords:Lysine  Metal complex  pH electric titration  Stability constant  Quantum chemical calculation  
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