Please use this identifier to cite or link to this item: http://nopr.niscpr.res.in/handle/123456789/15640
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dc.contributor.authorFan, Xuezhong-
dc.contributor.authorZhu, Chunhua-
dc.contributor.authorGongh, Xuedong-
dc.contributor.authorXiaoh, Heming-
dc.date.accessioned2013-01-07T16:31:13Z-
dc.date.available2013-01-07T16:31:13Z-
dc.date.issued1999-03-
dc.identifier.urihttp://hdl.handle.net/123456789/15640-
dc.description267-270en_US
dc.description.abstractThe geometries and electronic structures of 2- [2-(6-methylbenzothiazolyl)azo]-5-dimethylaminobenzoic acid (6-Me-BTAMB) and 2-[2-(6-methylbenzothiazolyl)azo]-5-diethylaminobenzoic acid (6-Me-BTAEB) have been fully optimized and calculated by semiempirical molecular orbital AM1 method. The mechanism of protonation for nitrogen atoms in 6-Me-BTAMB or 6-Me-BTAEB has been studied by comparison of net charges on nitrogen atoms in the different positions of the molecules.en_US
dc.language.isoen_USen_US
dc.publisherNISCAIR-CSIR, Indiaen_US
dc.rights CC Attribution-Noncommercial-No Derivative Works 2.5 Indiaen_US
dc.sourceIJC-A Vol.38A(03) [March 1999]en_US
dc.titleAM1 study on the conformations of thiazolylazo dyes 2-[2-(6-methylbenzothiazolyl) azo]-5-dimethylaminobenzoic acid and 2-[2-(6-methylbenzothiazolyl) azo]-5-diethylaminobenzoic aciden_US
dc.typeArticleen_US
Appears in Collections:IJC-A Vol.38A(03) [March 1999]

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