
TY  - JOUR
A1  - Spurling, TH 
A1  - Winkler, DA 
T1  - CNDO/2 Calculations for Organohalides
JF  - Australian Journal of Chemistry
JO  - Aust. J. Chem.
Y1  - 1986
VL  - 39
IS  - 2
SP  - 233
EP  - 237
KW  - 
UR  - https://doi.org/10.1071/CH9860233 
N2  - A CNDO/2 parameterization for performing semiempirical molecular orbital calculations for organic molecules containing bromine and iodine is presented; the results are superior to those from other parameterizations, and generally agree with ab initio calculations and experiment. 
ER  -

