Please use this identifier to cite or link to this item:
https://hdl.handle.net/10316/15609| Title: | A Molecular Mechanics Force Field for Conformational Analysis of Simple Acylchlorides, Carboxylic and Esters | Authors: | Teixeira-Dias, J. J. C. Fausto, Rui |
Issue Date: | May-1986 | Publisher: | Elsevier B.V. | Serial title, monograph or event: | J.Mol.Struct. | Volume: | 144 | Abstract: | Abstract A molecular mechanics force field for conformational and vibrational studies on acyl chlorides, carboxylic acids and esters is developed. The resulting force field can also be applied to alkanes, alcohols and ethers. Chlorine atoms and alkyl groups are considered as α-substituents | URI: | https://hdl.handle.net/10316/15609 | DOI: | 10.1016/0022-2860(89)85068-9 | Rights: | openAccess |
| Appears in Collections: | FCTUC Química - Artigos em Revistas Internacionais |
Files in This Item:
| File | Description | Size | Format | |
|---|---|---|---|---|
| J.Mol.Struct.pdf | 12.96 MB | Adobe PDF | View/Open |
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