Publication detail

Electronic charges at Nitrogen Atoms of Primarily Split Off Nitro Groups Versus Sensitivities of Some Nitramines

ZEMAN, S.

Original Title

Electronic charges at Nitrogen Atoms of Primarily Split Off Nitro Groups Versus Sensitivities of Some Nitramines

Type

conference paper

Language

English

Original Abstract

Electronic charges q at nitrogen atoms of 15 nitramines were calculated by means of DFT B3LYP/6-31G** method. The relationships have been confirmed and these directly specify the most reactive nitro groups.

Key words in English

electronic charges, nitro groups, sensitivities, nitramines

Authors

ZEMAN, S.

Released

1. 10. 2003

Publisher

Beijing Institute of Technology

Location

Beijing

Pages from

710

Pages to

718

Pages count

9

BibTex

@inproceedings{BUT11080,
  author="Svatopluk {Zeman}",
  title="Electronic charges at Nitrogen Atoms of Primarily Split Off Nitro Groups Versus Sensitivities of Some Nitramines",
  booktitle="Proc. 2003 IASPEP",
  year="2003",
  pages="9",
  publisher="Beijing Institute of Technology",
  address="Beijing"
}