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Investigation of the electronic structure of 4‐chlorophenylisoxazole and 4‐chloroisoxazoline by NQR spectroscopy and quantum‐chemical calculations
Authors:
- O.Kh. Poleshchuk,
- Boleslaw Nogaj,
- Jolanta Natalia Latosińska,
- Jacek Koput,
- T.A. Babushkina,
- S.D. Sokolov
Abstract
35Cl NQR spectra of substituted phenylisoxazoles and isoxazolines were analysed. For certain molecules the atom charges and orbital populations were calculated with the MINDO/3 method. It was proved that a chlorine atom at position 4 on an isoxazole ring transmits the influence from the phenyl ring at position 3 to the phenyl ring at position 5 on the isoxazole ring through the system of π‐bonds. Copyright © 1994 John Wiley & Sons Limited
- Record ID
- UAMe97ce4c78111411ea4af1a179d182f08
- Author
- Journal series
- Magnetic Resonance in Chemistry, ISSN 0749-1581
- Issue year
- 1994
- Vol
- 32
- Pages
- 573-577
- ASJC Classification
- ;
- DOI
- DOI:10.1002/mrc.1260321002 opening in a new tab
- Language
- en English
- Score (nominal)
- 20
- Score source
- journalList
- Publication indicators
- = 0.000; : 1999 = 0.867; : 2006 = 1.610 (2) - 2007=1.489 (5)
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- Uniform Resource Identifier
- https://researchportal.amu.edu.pl/info/article/UAMe97ce4c78111411ea4af1a179d182f08/
* presented citation count is obtained through Internet information analysis and it is close to the number calculated by the Publish or Perishopening in a new tab system.
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