Spectroscopic and computational study of a new thiazolylazonaphthol dye 1-[(5-(3-nitrobenzyl)-1,3-thiazol-2-yl)diazenyl]naphthalen-2-ol
作者： Orest Fedyshyn , Yaroslav Bazeľ , Maksym Fizer , Vasyl Sidey , Jan Imrich
DOI: 10.1016/J.MOLLIQ.2020.112713
关键词:
摘要: … Thus, water samples of Mn(II), Ni(II), and Co(II) ions were … for the determination of Ni(II), and Zn(II) ions, where TAN was … in the thiazolylazo-2-naphthol fragments of the two dyes. Tables …
sci-hub.se 参考文章(89)
Per-Olov Löwdin, On the Nonorthogonality Problem Advances in Quantum Chemistry. ,vol. 5, pp. 185- 199 ,(1970) , 10.1016/S0065-3276(08)60339-1
R. S. Mulliken, Electronic Population Analysis on LCAO–MO Molecular Wave Functions. I The Journal of Chemical Physics. ,vol. 23, pp. 1833- 1840 ,(1955) , 10.1063/1.1740588
M.M. Omar, Gehad G. Mohamed, Potentiometric, spectroscopic and thermal studies on the metal chelates of 1-(2-thiazolylazo)-2-naphthalenol. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy. ,vol. 61, pp. 929- 936 ,(2005) , 10.1016/J.SAA.2004.05.040
R. Krishnan, J. S. Binkley, R. Seeger, J. A. Pople, Self‐consistent molecular orbital methods. XX. A basis set for correlated wave functions Journal of Chemical Physics. ,vol. 72, pp. 650- 654 ,(1980) , 10.1063/1.438955
John P. Perdew, Kieron Burke, Matthias Ernzerhof, Generalized Gradient Approximation Made Simple Physical Review Letters. ,vol. 77, pp. 3865- 3868 ,(1996) , 10.1103/PHYSREVLETT.77.3865
Axel D. Becke, A New Mixing of Hartree-Fock and Local Density-Functional Theories Journal of Chemical Physics. ,vol. 98, pp. 1372- 1377 ,(1993) , 10.1063/1.464304
P. A. Belaykov, V. P. Ananikov, Modeling of NMR spectra and signal assignment using real-time DFT/GIAO calculations Russian Chemical Bulletin. ,vol. 60, pp. 783- 789 ,(2011) , 10.1007/S11172-011-0125-8
Patrícia Xavier Baliza, Sérgio Luis Costa Ferreira, Leonardo Sena Gomes Teixeira, Application of pyridylazo and thiazolylazo reagents in flow injection preconcentration systems for determination of metals. Talanta. ,vol. 79, pp. 2- 9 ,(2009) , 10.1016/J.TALANTA.2009.02.055
S.S. Chavan, V.A. Sawant, Synthesis, structural characterization, thermal and electrochemical studies of Mn(II), Co(II), Ni(II) and Cu(II) complexes containing thiazolylazo ligands Journal of Molecular Structure. ,vol. 965, pp. 1- 6 ,(2010) , 10.1016/J.MOLSTRUC.2009.11.010
Alan E. Reed, Robert B. Weinstock, Frank Weinhold, Natural population analysis Journal of Chemical Physics. ,vol. 83, pp. 735- 746 ,(1985) , 10.1063/1.449486