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https://scholarbank.nus.edu.sg/handle/10635/76081
| Title: | Electronic structure of thiophenes with mixed substituents | Authors: | Novak, I. Ng, S.C. Chua, Y.T. Mok, C.Y. Huang, H.H. |
Issue Date: | 1-Jul-1993 | Citation: | Novak, I.,Ng, S.C.,Chua, Y.T.,Mok, C.Y.,Huang, H.H. (1993-07-01). Electronic structure of thiophenes with mixed substituents. Journal of Electron Spectroscopy and Related Phenomena 63 (1) : 85-90. ScholarBank@NUS Repository. | Abstract: | He I photoelectron spectra of title compounds were recorded and assigned by MNDO-PM3 calculations and comparison with spectra of related derivatives. Substituents were found to noticeably affect the electronic structure, depending on their type and position of attachment to the ring. MNDO-PM3 calculation results become unreliable in cases of thiophenes with widely different substituent types. © 1993. | Source Title: | Journal of Electron Spectroscopy and Related Phenomena | URI: | http://scholarbank.nus.edu.sg/handle/10635/76081 | ISSN: | 03682048 |
| Appears in Collections: | Staff Publications |
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