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http://nopr.niscair.res.in/handle/123456789/6681
Title: | Study of [1,3] sigmatropic hydrogen migration in uracil, uridine and uridylic acid by AM1 method |
Authors: | Rao, Bojja Rajeshwar |
Keywords: | Frontier molecular orbital;[1,3] sigmatropic rearrangement;tautomers;conformations |
Issue Date: | Sep-2006 |
Publisher: | CSIR |
IPC Code: | Int. Cl.8 C07D |
Abstract: | The geometry and electronic structures of uracil, uridine and uridylic acid involving [1,3] sigmatropic hydrogen migration in the formation of tautomers have been fully optimized and evaluated by semi-empirical molecular orbital AM1 method. In this connection, the heats of formation (![]() ![]() |
Page(s): | 2083-2090 |
URI: | http://hdl.handle.net/123456789/6681 |
ISSN: | 0975-0983(Online); 0376-4699(Print) |
Appears in Collections: | IJC-B Vol.45B(09) [September 2006] |
Files in This Item:
File | Description | Size | Format | |
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IJCB 45B(9) 2083-2090.pdf | 82.71 kB | Adobe PDF | View/Open |
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