The geometry of 2-mercaptobenzothiazole （MBT） and its tautomeric form of benzothiazole-2-thione are optimized at B3LYP/6-311 G＊＊ and HF/6-311 G＊＊ levels, respectively. The crystal structure of benzothiazole-2-th...The geometry of 2-mercaptobenzothiazole （MBT） and its tautomeric form of benzothiazole-2-thione are optimized at B3LYP/6-311 G＊＊ and HF/6-311 G＊＊ levels, respectively. The crystal structure of benzothiazole-2-thione and its FFIR spectra are also obtained. From the calculated and experimental data, it can be concluded that in gas-phase and solid-state, the real existing form of 2-mercaptobenzothiazole is the thione-form of MBT.展开更多
Cyclic voltammetry is used to study the electrochemical behavior of CoCl 2, Co(dppe) 2Cl 2 and Co(mbt S,N) 2(dppe) [Hmbt=2 mercaptobenzothiazole; dppe=1,2 (diphenylphosphino)] in DMF or MeCN solution with 0...Cyclic voltammetry is used to study the electrochemical behavior of CoCl 2, Co(dppe) 2Cl 2 and Co(mbt S,N) 2(dppe) [Hmbt=2 mercaptobenzothiazole; dppe=1,2 (diphenylphosphino)] in DMF or MeCN solution with 0.1 mol·L -1 Bu n 4NBF 4 as electrolyte on the Pt electrode. The results indicate that the reduction potential, transfer coefficient and diffusion coefficient of Co(Ⅱ), Co(dppe)(Ⅱ) and Co(mbt S,N) 2(dppe) in DMF and MeCN depend on the solvent coordinated species, the volume and structure of ion. This is the characterization of the synergistic coordination effect.展开更多
Interfacial proton transfer reactions of pure mercaptoacetic acid (MA) and 2-mercaptobenzothiazole (Mbz) mixed self-assembled monolayers (SAMs) have been studied using a.c. impedance titration method. The charge-trans...Interfacial proton transfer reactions of pure mercaptoacetic acid (MA) and 2-mercaptobenzothiazole (Mbz) mixed self-assembled monolayers (SAMs) have been studied using a.c. impedance titration method. The charge-transfer resistance (Rct,) is measured with the monolayer composition and the ionic strength of pH solution. The surface pKa can be obtained by the plots of Rct and pH, the reasons of shifts of surface pKa are also explained.展开更多
基金This work was supported by the Natural Science Foundation of Shandong Province (No.Y2002B06)
文摘The geometry of 2-mercaptobenzothiazole （MBT） and its tautomeric form of benzothiazole-2-thione are optimized at B3LYP/6-311 G＊＊ and HF/6-311 G＊＊ levels, respectively. The crystal structure of benzothiazole-2-thione and its FFIR spectra are also obtained. From the calculated and experimental data, it can be concluded that in gas-phase and solid-state, the real existing form of 2-mercaptobenzothiazole is the thione-form of MBT.
文摘Cyclic voltammetry is used to study the electrochemical behavior of CoCl 2, Co(dppe) 2Cl 2 and Co(mbt S,N) 2(dppe) [Hmbt=2 mercaptobenzothiazole; dppe=1,2 (diphenylphosphino)] in DMF or MeCN solution with 0.1 mol·L -1 Bu n 4NBF 4 as electrolyte on the Pt electrode. The results indicate that the reduction potential, transfer coefficient and diffusion coefficient of Co(Ⅱ), Co(dppe)(Ⅱ) and Co(mbt S,N) 2(dppe) in DMF and MeCN depend on the solvent coordinated species, the volume and structure of ion. This is the characterization of the synergistic coordination effect.
文摘Interfacial proton transfer reactions of pure mercaptoacetic acid (MA) and 2-mercaptobenzothiazole (Mbz) mixed self-assembled monolayers (SAMs) have been studied using a.c. impedance titration method. The charge-transfer resistance (Rct,) is measured with the monolayer composition and the ionic strength of pH solution. The surface pKa can be obtained by the plots of Rct and pH, the reasons of shifts of surface pKa are also explained.
