Theoretical study of the medium polarity influence on the OH-acids strength
| dc.contributor.author | Pustolaikina, I.A. | |
| dc.contributor.author | Kutzhanova, K.Zh. | |
| dc.contributor.author | Kurmanova, A.F. | |
| dc.contributor.author | Batyrova, E.R. | |
| dc.contributor.author | Toleutai, D.K. | |
| dc.date.accessioned | 2019-03-19T05:52:38Z | |
| dc.date.available | 2019-03-19T05:52:38Z | |
| dc.date.issued | 2014-03-29 | |
| dc.description.abstract | Deprotonation energy for a number of OH-acids theoretically estimated by UHF 6–31G ab initio CPCM methods using Gaussian-2009. Reducing of acids deprotonation energy with increasing of the medium polarity is shown by quantum chemical methods. Theoretical justification of EPR spectroscopic data on decrease of rate of the proton exchange reaction between semiquinone radical 3,6-di-tert-butyl-2-oxyphenoxyl and some carboxylic acids in polar media is given. | ru_RU |
| dc.identifier.citation | Theoretical study of the medium polarity influence on the OH-acids strength / I.A.Pustolaikina [et al.] // Қарағанды универисетінің хабаршысы. ХИМИЯ Сериясы.=Вестник Карагандинского университета. Серия ХИМИЯ.=Bulletin of the Karaganda University. CHEMISTRY Series. – 2014. - № 1. - P.8-14. | ru_RU |
| dc.identifier.issn | 0142-0843 | |
| dc.identifier.uri | https://rep.buketov.edu.kz:80//handle/data/4471 | |
| dc.language.iso | en | ru_RU |
| dc.publisher | KSU Publ. | ru_RU |
| dc.relation.ispartofseries | Қарағанды универисетінің хабаршысы. ХИМИЯ Сериясы.=Вестник Карагандинского университета. Серия ХИМИЯ.=Bulletin of the Karaganda University. CHEMISTRY Series.;№ 1(73)/ 2014 | |
| dc.subject | OH-acids | ru_RU |
| dc.subject | semiquinone radicals | ru_RU |
| dc.subject | protolytic reaction | ru_RU |
| dc.subject | proton exchange reaction | ru_RU |
| dc.subject | deprotonation energy | ru_RU |
| dc.subject | solvation | ru_RU |
| dc.subject | acidity and basicity | ru_RU |
| dc.subject | quantum chemical calculations | ru_RU |
| dc.subject | ab initio | ru_RU |
| dc.subject | Gaussian-2009 | ru_RU |
| dc.title | Theoretical study of the medium polarity influence on the OH-acids strength | ru_RU |
| dc.title.alternative | ОН-қышқылдарының күшіне орта полярлығының əсерін теориялық зерттеу | ru_RU |
| dc.title.alternative | Теоретическое изучение влияния полярности среды на силу ОН-кислот | ru_RU |
| dc.type | Article | ru_RU |