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https://doi.org/10.5562/cca2462

Simple Method for the Estimation of pKa of Amines

Ivan Juranić   ORCID icon orcid.org/0000-0003-1049-9725 ; Department of Chemistry, University of Belgrade, P.O.Box 473, 11001 Belgrade, Serbia

Puni tekst: engleski, pdf (768 KB) str. 343-347 preuzimanja: 1.657* citiraj
APA 6th Edition
Juranić, I. (2014). Simple Method for the Estimation of pKa of Amines. Croatica Chemica Acta, 87 (4), 343-347. https://doi.org/10.5562/cca2462
MLA 8th Edition
Juranić, Ivan. "Simple Method for the Estimation of pKa of Amines." Croatica Chemica Acta, vol. 87, br. 4, 2014, str. 343-347. https://doi.org/10.5562/cca2462. Citirano 22.09.2019.
Chicago 17th Edition
Juranić, Ivan. "Simple Method for the Estimation of pKa of Amines." Croatica Chemica Acta 87, br. 4 (2014): 343-347. https://doi.org/10.5562/cca2462
Harvard
Juranić, I. (2014). 'Simple Method for the Estimation of pKa of Amines', Croatica Chemica Acta, 87(4), str. 343-347. https://doi.org/10.5562/cca2462
Vancouver
Juranić I. Simple Method for the Estimation of pKa of Amines. Croatica Chemica Acta [Internet]. 2014 [pristupljeno 22.09.2019.];87(4):343-347. https://doi.org/10.5562/cca2462
IEEE
I. Juranić, "Simple Method for the Estimation of pKa of Amines", Croatica Chemica Acta, vol.87, br. 4, str. 343-347, 2014. [Online]. https://doi.org/10.5562/cca2462

Sažetak
A simple and efficient model for the estimation of alkylamine basicities (through corresponding pKa values) is developed. Model uses partial atomic charges of hydrogen and of neighboring nitrogen cal-culated by MNDO-PM6 semiempirical model, taking into account the order of the substitution on nitrogen.

Ključne riječi
amine pKa constants; partial atomic charges; MNDO-PM6 calculations

Hrčak ID: 131527

URI
https://hrcak.srce.hr/131527

Posjeta: 1.877 *