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Öğe Cationic versus anionic Pt complex: The performance analysis of a hybrid-capacitor, DFT calculation and electrochemical properties(Pergamon-Elsevier Science Ltd, 2019) Akkoc, Mitat; Demirel, Serkan; Oz, Erdinc; Altin, Serdar; Bayri, Ali; Dorcet, Vincent; Roisnel, ThierryThe synthesis and characterization of cationic versus anionic platinum(II) complex of the type [PtCl3(DMSO)](-)[NHC](+) (NHC: N-heterocyclic carbene) is reported for the first time. The complex 3 was synthesized from silver(I)-NHC2, and K-2[PtCl4] in DMSO at 80 degrees C under exclusion of light. The ionic platinum(II) complex was obtained in high yield and fully characterized by H-1, C-13, Pt-195 NMR and HRMS spectroscopy, X-ray diffraction and elemental analysis. The structural properties of the complex were investigated by using Gaussian suit and the obtained parameters were crosschecked with the X-ray data. The HOMO-LUMO energies and electrostatic surface mapping of the complex were calculated and the results were discussed with the capacitive properties of the complex. Electrochemical analysis by cyclic voltammetry (CV) of the complex shows reversible redox peaks about platinum center. The complex was used as an electrode material for the capacitor device and result is promising that the highest performance of complex 3 was found as 10.22 F/g. (C) 2018 Elsevier Ltd. All rights reserved.Öğe An Efficient Protocol for Palladium N-Heterocyclic Carbene-Catalysed Suzuki-Miyaura Reaction at room temperature(Wiley-V C H Verlag Gmbh, 2017) Akkoc, Mitat; Imik, Fatma; Yasar, Sedat; Dorcet, Vincent; Roisnel, Thiery; Bruneau, Christian; Ozdemir, IsmailThe palladium-N-heterocyclic carbene complexes have been synthesised from 1,3-bis-(N-alkyl) benzimidazolium salts and catalytic activity of complexes have been tested on Suzuki-Miyaura coupling reaction for aryl bromides with substituted arylboronic acids at room temperature in i-PrOH/water. Structural characterisation of palladium complex 2b was determined by x-ray crystallography. A convenient and effective protocol has been evolved that has several superior advantages, including very low catalyst loading, vide range of substrate tolerance, excellent yields, room temperature, totally green solvents, short reaction times, up to 59750 h(-1) TOF (Turn Over Frequency) value with aryl bromide substrates and very simple procedure.Öğe Investigation of hybrid-capacitor properties of ruthenium complexes(Wiley-Hindawi, 2019) Altin, Serdar; Oz, Erdinc; Altundag, Sebahat; Bayri, Ali; Roisnel, Thierty; Dorcet, Vincent; Bruneau, ChristianRu complexes were successfully produced, and their structural properties were investigated using FTIR, Raman, and single crystal XRD patterns. The HOMO, LUMO, Eg, and electronic surface potential (ESP) values of the molecules were calculated by a Gaussian program. The complexes were used for producing hybrid capacitor cells as electrode materials. According to electrochemical analysis, complex 2 showed the best CV graph between -1 V and +1 V and had the highest current value and hysteresis area when compared with the other complexes. The performance analysis and the capacity fade of the cells were investigated. The first capacity values of the complexes were 57.5, 22.1, 16.9, and 0.0021 F/g for complexes 1, 2, 3, and 4, respectively. The capacitive mechanism of the cells as relates to molecular interactions was also investigated. We suggested that the ESP values of the molecules were directly related to the capacitive performance of the cells. In addition to this, the best cycling performance was obtained for complex 2, which has the lowest Eg value among the complexes. We speculate that the charged regions on the complex materials have a crucial role in the increasing the capacitance of the cells.Öğe Investigation of potential hybrid capacitor property of chelated N-Heterocyclic carbene Ruthenium(II) complex(Elsevier Science Sa, 2018) Akkoc, Mitat; Oz, Erdinc; Demirel, Serkan; Dorcet, Vincent; Roisnel, Thierry; Bayri, Ali; Bruneau, ChristianThe synthesis of chelated ruthenium(II) complex type Ru(eta(6)-HMB) (NHC) Cl (NHC = N-heterocyclic carbene, HMB = hexamethylbenzene) is presented. The ruthenium(II)-NHC complex 6 was obtained in good yield and was fully characterised by NMR spectroscopy, X-ray diffraction and HRMS analysis. Electrochemical analysis by cyclic voltammetry (CV) revealed reversible redox behaviour at the ruthenium centre in 6. DFT studies and the catalytic activity of complex 6 on transfer hydrogenation reaction of aryl ketones are also presented. The potential hybrid capacitor applications of Ru-NHC complex is discussed and reported firstly in the literature. It was found that the highest performance was found at 20.1 F/g, which is a promising result for energy storage applications. (c) 2018 Elsevier B.V. All rights reserved.Öğe PEPPSI-Type Palladium-NHC Complexes: Synthesis, Characterization, and Catalytic Activity in the Direct C5-Arylation of 2-Substituted Thiophene Derivatives with Aryl Halides(Wiley-V C H Verlag Gmbh, 2017) Kaloglu, Murat; Ozdemir, Ismail; Dorcet, Vincent; Bruneau, Christian; Doucet, HenriSix benzimidazolium salts, having two nitrogen atoms substituted by various alkyl groups, have been synthesized in high yields. The benzimidazolium salts readily converted into the corresponding PEPPSI-type palladium-NHC complexes (PEPPSI = pyridine-enhanced precatalyst preparation, stabilization, and initiation). The structures of all compounds have been characterized by H-1 NMR, C-13 NMR, and IR spectroscopy, as well as elemental analysis techniques, which support the proposed structures. The molecular structure of one complex has been determined by single-crystal X-ray diffraction. The catalytic activity of the PEPPSI-type palladium-NHC complexes has been evaluated with respect to the direct C5-arylation of 2-substituted thiophene derivatives with various aryl halides. This arylation occurs efficiently and selectively at the C5-position of 2-substituted thiophene derivatives.
