Browsing by Author "Kurt, Mustafa"
Now showing items 1-20 of 48
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1H-benzimidazole-2-carboxylic acid monohydrate molekülünün elektronik yapısı ve çözücü etkisi
Çifçi, Songül (Ahi Evran Üniversitesi, 2014)Bu çalışmada, 1H-Benzimidazole-2-Carboxylic acid monohydrate molekülünün (C8H8N2O3 . H2O) spektroskopik özellikleri, IR, Raman, UV-Vis spektroskopi teknikleriyle teorik olarak incelendi. 1H-Benzimidazole-2-Carboxylic acid ... -
3-bromofenil boronik asit molekülünün moleküler yapı parametreleri ve titreşim frekanslarına çözücü etkisinin deneysel ve teorik olarak incelenmesi
Dirlik, Onur (Ahi Evran Üniversitesi, 2013)Bu çalışmada, 3-Bromofenilboronik asit (3-Brfba) molekülünün Raman ve FT-IR spektrumları katı fazda kaydedildi. 3-Brfba molekülünün yapısal ve spektroskopik analizleri gerçekleştirilmiş ve 3-Brfba kararlı bir şekle ... -
4-(2-Piridilazo) rezorsinol monosodyum molekülünün ve komplekslerinin titreşimsel spektrumu
Korkut, Sinem Zahide (Ahi Evran Üniversitesi, 2013)4-(2-PİRİDİLAZO) REZORSİNOL MONOSODYUM MOLEKÜLÜNÜN VE KOMPLEKSLERİNİN TİTREŞİMSEL SPEKTRUMUSinem Zahide KORKUTBu çalışmada ???????? 2 ???? 2 ( ???? = ???????? , ???????? ; ???? = ???? 11 ???? 8 ???? 3 ???????????? 2× ???? ... -
Comparison of experimental and density functional study on the molecular structure, infrared and Raman spectra and vibrational assignments of 6-chloronicotinic acid
Karabacak, Mehmet; Kurt, Mustafa (PERGAMON-ELSEVIER SCIENCE LTD, 2008)The experimental and theoretical study on the structures and vibrations of 6-chloronicotinic acid (6-CNA, C(6)H(4)ClNO(2)) are presented. The Fourier transform infrared spectra (4000-50cm(-1)) and the Fourier transform ... -
Comparison of theoretical and experimental electronic and optoelectronic properties of HPS compound
Şaş, Emine Babür; Tanış, Emine; Gündüz, Bayram; Kurt, Mustafa (Institute of Physics Publishing, 2019)We investigated electronic and optoelectronic properties of 1,1,2,3,4,5-Hexaphenyl-1H-silole (HPS) compound for different concentrations and for theoretical (B3LYP and CAM) and experimental methods. Optical parameters such ... -
Determination of structural, spectrometric and nonlinear optical features of 2-(4-hydroxyphenylazo)benzoic acid by experimental techniques and quantum chemical calculations
Cinar, Mehmet; Yildiz, Nihat; Karabacak, Mehmet; Kurt, Mustafa (PERGAMON-ELSEVIER SCIENCE LTD, 2013)The optimized geometrical structure, vibrational and electronic transitions, chemical shifts and nonlinear optical properties of 2-(4-hydroxyphenylazo)benzoic acid (HABA) compound were presented in this study. The ground ... -
DFT based computational study on the molecular conformation, NMR chemical shifts and vibrational transitions for N-(2-methylphenyl) methanesulfonamide and N-(3-methylphenyl) methanesulfonamide
Karabacak, Mehmet; Cinar, Mehmet; Kurt, Mustafa (ELSEVIER SCIENCE BV, 2010)This paper presents a DFT quantum chemical investigation of the molecular conformation, NMR chemical shifts and vibrational transitions of N-(2-methylphenyl)methanesulfonamide and N-(3-methylphenyl)methanesulfonamide ... -
DFT, FT-IR, FT-Raman and NMR studies of 4-(substituted phenylazo)-3,5-diacetamido-1H-pyrazoles
Kinali, Selin; Demirci, Serkan; Calisir, Zuhre; Kurt, Mustafa; Atac, Ahmet (ELSEVIER SCIENCE BV, 2011)We present a detailed analysis of the structural and vibrational spectra of some novel azo dyes. 2-(Substituted phenylazo)malononitriles were synthesized by the coupling reaction of the diazonium salts, which were prepared ... -
DFT, FT-Raman, FT-IR and NMR studies of 2-fluorophenylboronic acid
Erdogdu, Yusuf; Gulluoglu, M. Tahir; Kurt, Mustafa (WILEY-BLACKWELL, 2009)The experimental and theoretical vibrational spectra of 2-fluorophenylboronic acid (2fpba) were studied. The Fourier transform Raman and Fourier transform infrared spectra of the 2fpba molecule were recorded in the solid ... -
Effect of Fe doping on the CO gas sensing of functional calixarene molecules measured with quartz crystal microbalance technique
Ozbek, Cebrail; Okur, Salih; Mermer, Omer; Kurt, Mustafa; Sayin, Serkan; Yilmaz, Mustafa (ELSEVIER SCIENCE SA, 2015)This article presents comprehensive studies of carbon monoxide (CO) responses of bare and iron doped six calix[4]arene derivatives substituted with various functional groups based on quartz crystal microbalance (QCM) ... -
Experimental (FT-IR and FT-Raman spectra) and theoretical (ab initio HF, DFT) study of 2-chloro-5-methylaniline
Karabacak, Mehmet; Karagoez, Dilek; Kurt, Mustafa (ELSEVIER SCIENCE BV, 2008)In this work, the experimental and theoretical vibrational spectra of 2-chloro-5-methylaniline (2C15MA, C7H8NCl) were studied. FF-IR and FT-Raman spectra of 2Cl5MA in the liquid phase were recorded in the region 4000-400 ... -
Experimental (UV, NMR, IR and Raman) and theoretical spectroscopic properties of 2-chloro-6-methylaniline
Karabacak, Mehmet; Kurt, Mustafa; Cinar, Mehmet; Coruh, Ali (TAYLOR & FRANCIS LTD, 2009)In this work, the experimental and theoretical UV, NMR and vibrational spectra of 2-chloro-6-methylaniline (2-Cl-6-MA, C7H8NCl) were studied. The ultraviolet absorption spectra of compound that dissolved in ethanol were ... -
Experimental and theoretical FT-IR and FT-Raman spectroscopic analysis of N1-methyl-2-chloroaniline
Karabacak, Mehmet; Kurt, Mustafa; Atalc, Ahmet (WILEY-BLACKWELL, 2009)In this work, the experimental and theoretical vibrational spectra of N1-methyl-2-chloroaniline (C7H8NCl) were studied. FT-IR and FT-Raman spectra of the title molecule in the liquid phase were recorded in the region ... -
An experimental and theoretical study of molecular structure and vibrational spectra of 2-chloronicotinic acid by density functional theory and ab initio Hartree-Fock calculations
Karabacak, Mehmet; Cinar, Mehmet; Kurt, Mustafa (ELSEVIER SCIENCE BV, 2008)In this work, the Fourier transform Raman and Fourier transform infrared spectra of 2-chloronicotinic acid (2-CNA) are recorded in the solid phase. The molecular geometry, vibrational frequencies, infrared intensities and ... -
An experimental and theoretical study of molecular structure and vibrational spectra of pentafluorophenylboronic acid molecule by density functional theory and ab initio Hartree Fock calculations
Kurt, Mustafa (ELSEVIER SCIENCE BV, 2008)In this work, the Fourier transform Raman and Fourier transform infrared spectra of pentafluorophenylboronic acid (= pfpa) were recorded in the solid phase. The structural and spectroscopic analysis of the pentafluorophenylboronic ... -
Experimental vibrational spectra (Raman, infrared) and DFT calculations on monomeric and dimeric structures of 2-and 6-bromonicotinic acid
Karabacak, Mehmet; Cinar, Mehmet; Ermec, Sahin; Kurt, Mustafa (JOHN WILEY & SONS LTD, 2010)In this work, the Fourier transform infrared and Raman spectra of 2-bromonicotinic acid and 6-bromonicotinic acid (abbreviated as 2-BrNA and 6-BrNA, C(6)H(4)BrNO(2)) have been recorded in the region 4000-400 and 3500-50 ... -
Experimental, Semi-theoretical, and Theoretical Electronic and Non-linear Optical Characteristics of ECBP
Tanış, Emine; Şaş, Emine Babur; Gündüz, Bayram; Kurt, Mustafa (Springer, 2020)The electronic properties of 4,4 '-bis(3-ethyl-N-carbazolyl)-1,1 '-biphenyl (ECBP) have been studied using time-dependent density functional theory. The non-linear optical (NLO) properties and dipole moments were investigated ... -
Farklı branşlardaki alan öğretmenlerinin sosyal yapılandırıcı yaklaşımla bilim anlayışlarının geliştirilmesi
Bu çalışmanın amacı Bilim ve Sanat Merkezi’nde görev yapmakta olan ve gökbilim kampı kapsamında mesleki geliŞim sürecine dahil olan öğretmenlerin (1) süreç boyunca bilimin doğası ile ilgili görüŞlerinde oluŞan değiŞiklikleri ... -
FT-IR, FT-Raman vibrational spectra and molecular structure investigation of 2-chloro-4-methylaniline: A combined experimental and theoretical study
Karabacak, Mehmet; Karagoez, Dilek; Kurt, Mustafa (PERGAMON-ELSEVIER SCIENCE LTD, 2009)In this work, the experimental and theoretical vibrational spectra of 2-Chloro-4-methylaniline (2Cl4MA, C7H8NCl) were Studied. FT-IR and FT-Raman spectra of 2Cl4MA in the liquid phase have been recorded in the region ...
