Structural Aspects of the <i>Ortho</i> Chloro- and Fluoro- Substituted Benzoic Acids: Implications on Chemical Properties
This article presents a detailed comprehensive investigation of the <i>ortho</i> fluoro- and chloro- substituted benzoic acids both, as isolated molecules and in the crystalline phase. Quantum chemical calculations performed within the density functional theory (DFT) formalism are used t...
| Main Authors: | , |
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| Format: | Article |
| Language: | English |
| Published: |
MDPI AG
2020-10-01
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| Series: | Molecules |
| Subjects: | |
| Online Access: | https://www.mdpi.com/1420-3049/25/21/4908 |