Research Article

Theorıtıcal Calculatıon Of Pka Of 1,2,4-Trıazole And Its Derıvatıves

Volume: 24 Number: 2 December 30, 2011
Erol Açıkkalp , Devrim Özöğüt , Semih Fidan
EN TR

Theorıtıcal Calculatıon Of Pka Of 1,2,4-Trıazole And Its Derıvatıves

Abstract

In the present resarch the acidity values pKa of  eight 1,2,4-triazole derivatives were calculated by using physicochemical semi-empirical methods (AM1,PM3,PM5) .CAChe 6.0 experimental pKa  values were compared to theoretical results  calculated with semi-empirical methods. It was found that the calculation methods using thermokinetic parameters and most experimental results werein good agurement.

Keywords

Triazole , CAChe 6.0 , semi-empirical methods (AM1 , PM3 , PM5)

References

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APA
Açıkkalp, E., Özöğüt, D., & Fidan, S. (2011). 1,2,4-TRİAZOL VE TÜREVLERİNİN pKa’LARININ TEORİK HESAPLANMASI. Eskişehir Osmangazi Üniversitesi Mühendislik Ve Mimarlık Fakültesi Dergisi, 24(2), 51-70. https://izlik.org/JA36XJ27SG
AMA
1.Açıkkalp E, Özöğüt D, Fidan S. 1,2,4-TRİAZOL VE TÜREVLERİNİN pKa’LARININ TEORİK HESAPLANMASI. Eskişehir Osmangazi Üniversitesi Mühendislik ve Mimarlık Fakültesi Dergisi. 2011;24(2):51-70. https://izlik.org/JA36XJ27SG
Chicago
Açıkkalp, Erol, Devrim Özöğüt, and Semih Fidan. 2011. “1,2,4-TRİAZOL VE TÜREVLERİNİN PKa’LARININ TEORİK HESAPLANMASI”. Eskişehir Osmangazi Üniversitesi Mühendislik Ve Mimarlık Fakültesi Dergisi 24 (2): 51-70. https://izlik.org/JA36XJ27SG.
EndNote
Açıkkalp E, Özöğüt D, Fidan S (December 1, 2011) 1,2,4-TRİAZOL VE TÜREVLERİNİN pKa’LARININ TEORİK HESAPLANMASI. Eskişehir Osmangazi Üniversitesi Mühendislik ve Mimarlık Fakültesi Dergisi 24 2 51–70.
IEEE
[1]E. Açıkkalp, D. Özöğüt, and S. Fidan, “1,2,4-TRİAZOL VE TÜREVLERİNİN pKa’LARININ TEORİK HESAPLANMASI”, Eskişehir Osmangazi Üniversitesi Mühendislik ve Mimarlık Fakültesi Dergisi, vol. 24, no. 2, pp. 51–70, Dec. 2011, [Online]. Available: https://izlik.org/JA36XJ27SG
ISNAD
Açıkkalp, Erol - Özöğüt, Devrim - Fidan, Semih. “1,2,4-TRİAZOL VE TÜREVLERİNİN PKa’LARININ TEORİK HESAPLANMASI”. Eskişehir Osmangazi Üniversitesi Mühendislik ve Mimarlık Fakültesi Dergisi 24/2 (December 1, 2011): 51-70. https://izlik.org/JA36XJ27SG.
JAMA
1.Açıkkalp E, Özöğüt D, Fidan S. 1,2,4-TRİAZOL VE TÜREVLERİNİN pKa’LARININ TEORİK HESAPLANMASI. Eskişehir Osmangazi Üniversitesi Mühendislik ve Mimarlık Fakültesi Dergisi. 2011;24:51–70.
MLA
Açıkkalp, Erol, et al. “1,2,4-TRİAZOL VE TÜREVLERİNİN PKa’LARININ TEORİK HESAPLANMASI”. Eskişehir Osmangazi Üniversitesi Mühendislik Ve Mimarlık Fakültesi Dergisi, vol. 24, no. 2, Dec. 2011, pp. 51-70, https://izlik.org/JA36XJ27SG.
Vancouver
1.Erol Açıkkalp, Devrim Özöğüt, Semih Fidan. 1,2,4-TRİAZOL VE TÜREVLERİNİN pKa’LARININ TEORİK HESAPLANMASI. Eskişehir Osmangazi Üniversitesi Mühendislik ve Mimarlık Fakültesi Dergisi [Internet]. 2011 Dec. 1;24(2):51-70. Available from: https://izlik.org/JA36XJ27SG