| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5384984 | Chemical Physics Letters | 2010 | 5 Pages |
Abstract
⺠Electronic structure of drug molecules busulfan and nabumetone has been determined by UV photoelectron spectroscopy and high-level ab initio calculations. ⺠The electronic structure of busulfan has been related to its biological activity as an alkylating agent. ⺠The electronic structure of nabumetone has been related to its metabolic transformation with the aid of molecular docking study. ⺠The electronic structure of mesyl group which is commonly encountered in organic chemistry has been studied for the first time.
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Authors
Igor Novak, Branka KovaÄ,