Please use this identifier to cite or link to this item:
http://nopr.niscpr.res.in/handle/123456789/20628| Title: | An analysis of the conformation and electronic structure of newly synthesized cryptand |
| Authors: | Abbasoglu, Riza Gok, Yasar |
| Issue Date: | May-2003 |
| Publisher: | NISCAIR-CSIR, India |
| Abstract: | Using molecular mechanical methods (MM2, AMBER, OPLS), a conformational analysis of a newly synthesized cryptand is made and its stable conformations are determined. The electronic structures of the stable conformations are analysed by the AM1 method, and its donor-acceptor characteristics are investigated. |
| Page(s): | 1013-1015 |
| ISSN: | 0975-0975(Online); 0376-4710(Print) |
| Appears in Collections: | IJC-A Vol.42A(05) [May 2003] |
Files in This Item:
| File | Description | Size | Format | |
|---|---|---|---|---|
| IJCA 42A(5) 1013-1015.pdf | 284.58 kB | Adobe PDF | View/Open |
Items in NOPR are protected by copyright, with all rights reserved, unless otherwise indicated.