Simulation of ~(13)C Chemical Shifts of Linear and Branched Alkanes Using Multiple Regression
Hu Jiang · Jisuanji yu yingyong huaxue · 2000
Multiple regression analysis was used for the simulation of the 13 C chemical shifts of 59 linear or branched alkanes. The results by using molecular connectivity index and geometrical parameters were superior to that Paul and Grant achieved by using geometrical parameters.