【作者】 陈美玲； 王正武； 王文德； 张革新； 陶福明；

【Author】 Mei-ling Chen1, *Zheng-Wu Wang1 , Wen-De Wang1, Ge-Xin Zhang1, Fu-Ming Tao2 1. School of Chemistry and Materials Engineering, Southern Yangtze University, 214036, Wuxi, Jiangsu 2. Department of Chemistry and Biochemistry, California State University, Fullerton, California 92834, USA

【机构】 江南大学化学与材料工程学院； Department of Chemistry and Biochemistry, California State University, Fullerton, California, 92834, USA；

【Abstract】 The CH3(CH2)7OSO3– molecular geometry and interaction with water molecules were calculated within the density functional theory. It was found that the interaction with water molecules forming a lock chain around the molecule of surfactant. The alkyl chain length is less shorted and degree of S10-O9-C8 is increased compared to the isolated CH3(CH2)7OSO3– molecule. It revealed that the alkyl chain is less inclined.更多还原