Structure and intramolecular lability of N-(thio)phosphoryl(thio)amides: XIV. Electronic structure and spatial arrangement of N-[diisopropoxy(thio)phosphoryl](thio)benzamides |
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| Authors: | F Kh Karataeva |
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| Institution: | (1) Kazan State Universiry, ul. Kremlevskaya 18, Kazan, Tatarstan, 420008, Russia |
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| Abstract: | Semiempirical quantum-chemical calculations of the spatial arrangement and electronic structure of the tautomeric forms of N-diisopropoxy(thio)phosphoryl](thio)benzamides were carried out by the PM3 method. The most energetically favorable forms were revealed, and the reasons for their stabilization were discussed. |
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