Research Article
Topological Model on the Inductive Effect in Alkyl Halides Using Local Quantum Similarity and Reactivity Descriptors in the Density Functional Theory
Table 9
MQS matrices of overlap.
| | Compound | C3H8 | C3H8F | C3H8Cl | C3H8Br | C3H8I |
| | C3H8 | 1.0000 | | | | | | C3H8F | 0.7427 | 1.0000 | | | | | C3H8Cl | 0.8895 | 0.8138 | 1.0000 | | | | C3H8Br | 0.9025 | 0.7697 | 0.9887 | 1.0000 | | | C3H8I | 0.9252 | 0.7318 | 0.9536 | 0.9800 | 1.0000 |
|
|
