摘要
用“溶液法”实测了o-、m-、p-MNT和2,3-、2,4-、2,5-、2,6-、3,4-以及3,5-DNT共9个化合物在CCl_4溶液中的偶极矩;用MINDO/3法计算了它们的气相偶极矩。二者符合良好,线性相关系数为0.996。
The dipole moments of nine compounds (o-, m-, p-MNT and2, 3-, 2, 4-, 2 , 5-, 2, 6-, 3, 4-, 3 , 5-DNT) in CCl_4 solution have been observedby using"solution method",and calculated in gas phase by using MINDO/3method. The experimental and calculated results comform to each other andthe linear correlation coefficient is 0. 996.
关键词
偶极矩
硝基甲苯
二硝基甲苯
dipole moment
nitrotoluene
dinitrotoluene
MINDO/3 calculation
