AB-INITIO STUDIES OF THIOFORMOHYDROXAMIC ACID

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SEKHON, BS
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O6 [化学];
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0703 ;
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Ab initio Hartree-Fock molecular orbital calculations for Z and E-keto forms of thioformohydroxamic acid (methanethioamide, N-hydroxy) were carried out using the 3-21 g* basis sets. The optimized parameters of thioformohydroxamic acid are discussed in relation to formohydroxamic acid.
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页码:237 / 238
页数:2
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