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Nonempirical study of oxyphosphonitride (PNO) isomers

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Bulletin of the Academy of Sciences of the USSR, Division of chemical science Aims and scope

Conclusions

Theoretical estimates were obtained for the first time for the molecular and electronic characteristics of the singlet and triplet states of oxyphosphonitride isomers and the transition states of their interconversions using the MP2(MP3)/DZ + P/3-21G approximations.

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Author information

Authors and Affiliations

  1. Institute of Physiologically Active Compounds, Academy of Sciences of the USSR, Chernegolovka

    A. A. Korkin, A. M. Mebel' & E. V. Borisov

  2. Institute of New Chemical Problems, Academy of Sciences of the USSR, Chernogolovka

    A. A. Korkin, A. M. Mebel' & E. V. Borisov

  3. V. I. Lenin Moscow State Pedagogical Institute, USSR

    A. A. Korkin, A. M. Mebel' & E. V. Borisov

Authors
  1. A. A. Korkin
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  2. A. M. Mebel'
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  3. E. V. Borisov
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Additional information

Translated from Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, No. 4, pp. 900–903, April, 1988.

The authors thank A. A. Bagatur'yants at the Institute of Organic Chemistry of the Academy of Sciences of the USSR for a helpful discussion of these results.

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Korkin, A.A., Mebel', A.M. & Borisov, E.V. Nonempirical study of oxyphosphonitride (PNO) isomers. Russ Chem Bull 37, 780–783 (1988). https://doi.org/10.1007/BF01455503

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  • DOI: https://doi.org/10.1007/BF01455503

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