Yazar "Şenyel, Mustafa" için listeleme
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1-fenilpiperazin molekülünün titreşim bandlarının kuantum kimyasal hesaplamalarla belirlenmesi ve bu moleküle ait Hofmann tipi kompleks ve klatratların titreşim spektroskopisiyle incelenmesi
Parlak, Cemal (Anadolu Üniversitesi, 2009)Bu çalışmada önce 1-Fenilpiperazin (pp) ligand molekülünün titreşim işaretlemeleri ve frekansları hem deneysel olarak hem de bazı kuantum kimyasal hesaplamalarla teorik olarak belirlenmiştir. Daha sonra, pp ligand molekülü ... -
2-(1-Siklohekzenil)etilamin tetrasiyanonikelat kompleksleri ile Hofmann-tipi klatratlarının spektroskopik ve gravimetrik olarak incelenmesi
İzgi, Tekin (Anadolu Üniversitesi, 2007)Bu çalışmada Hofmann-tipine benzer M(C8H15N)2Ni(CN)4 (M=Ni yada Cd) konak ve M (C8H55N)2Ni(CN)4.nG (M=Ni yada Cd; G=benzen, 1,2-diklorobenzen, 1,3- diklorobenzen, 1,4- diklorobenzen, naftalin; n=konuk molekül sayısı) ... -
3-fenil-1-propilamin molekülünün ve bu molekülden elde edilen bileşiklerin bazı fiziksel özelliklerinin kuantum kimyasal hesaplamalar ve spektroskopik yöntemlerle belirlenmesi
Ünal, Arslan (Anadolu Üniversitesi, 2010)Bu çalışmanın ilk aşamasında, 3-fenil-1-propilamin (3-fenilpropilamin: 3PPA) ligand molekülünün iç dönmelerine bağlı olarak en kararlı formu, deneysel ve teorik titreşim spektroskopisi yardımıyla belirlenmiştir. Son ... -
3-piperidino-propilamin molekülü ve bu moleküle ait bazı bileşiklerin spektroskopik özelliklerinin teorik ve deneysel incelenmesi
Alver, Özgür (Anadolu Üniversitesi, 2010)3-piperidino-propilamin (3-pipa) molekülüne ait, 13C, 1H, 15N, DEPT, COSY, HETCOR, INADEQUATE NMR, FT-IR, Raman ölçümleri ve titreşim işaretlemeleri ilk kez yapılmıştır. 3-pipa (C8H18N2) molekülü için n J(C, H) (n = 1, 2, ... -
4-Mercaptophenylboronic acid: Conformation, FT-IR, Raman, OH stretching and theoretical studies
Parlak, Cemal; Ramasami, Ponnadurai; Tursun, Mahir; Rhyman, Lydia; Kaya, Mehmet Fatih; Atar, Necip; Şenyel, Mustafa (Pergamon-Elsevier Science LTD, 2015)4-Mercaptophenylboronic acid (4-mpba, C6H7BO2S) was investigated experimentally by vibrational spectroscopy. The molecular structure and spectroscopic parameters were studied by computational methods. The molecular dimer ... -
Bazı piperazin türevleri ve metal komplekslerinin spektroskopik özelliklerinin deneysel ve teorik olarak incelenmesi
Bağlayan, Özge (Anadolu Üniversitesi, 2017)Bu çalışmada piperazin türevleri olan 1-siklobütilpiperazin, 1-bütilpiperazin, 1-siklopentilpiperazin ve 2-metilpiperazin moleküllerinin FT-IR ile Raman spektrumları sırasıyla 4000-30 cm-1 ve 4000-50 cm-1 bölgelerinde ... -
Computational study on favipiravir adsorption onto undoped-and silicon-decorated C60 fullerenes
Parlak, Cemal; Alver, Özgür; Şenyel, Mustafa (World Scientific Publ Co Pte LTD, 2017)Adsorption and interaction mechanisms of fullerene-based complex systems for possible drug delivery vehicles have been at the center of increasing attention. In the scope of this work, the interaction mechanism between an ... -
Conformation and NH stretching of 1,1-dihalogenoheptan-1-amines[CH3(CH2)(5)CX2NH2; X = F, Cl or Br]: Halogen and solvent effects
Tursun, Mahir; Rhyman, Lydia; Parlak, Cemal; Ramasami, Ponnadurai; Şenyel, Mustafa (Pergamon-Elsevier Science LTD, 2015)The effects of halogen and solvent on the conformation and NH stretching of 1,1-dihalogeno-heptan-1amines [CH3(CH2)(5)CX2NH2: X = F, Cl or Br] were investigated using the density functional theory method. The functional ... -
Conformational analysis and vibrational spectroscopic investigation of 3-phenylpropylamine
Ünal, Arslan; Şenyel, Mustafa; Şentürk, Sükrü (Elsevier Science BV, 2009)The possible stable forms of 3-phenylpropylamine (3-PPA) molecule were experimentally and theoretically studied by infrared and Raman spectroscopy. FT-IR and Raman spectra of 3-PPA were recorded in the regions of 4000-400 ... -
Conformational and electronic properties of hydroquinone adsorption on C60 fullerenes: Doping atom, solvent and basis set effects
Ergurhan, Orkun; Parlak, Cemal; Alver, Özgür; Şenyel, Mustafa (Elsevier Science BV, 2018)Hydroquinone (HQ) is widely used as a reducing agent with well-known antioxidant properties. The interaction with pristine and doped fullerenes seems to have a promising research field particularly for the drug delivery ... -
Crystallographic, vibrational and DFT studies of 1-(2-hydroxy-4,5-dimethylphenyl)ethanone
Kumar, Chandraju Sadolalu Chidan; Parlak, Cemal; Fun, Hoong Kun; Tursun, Mahir; Bilge, Metin; Chandraju, Siddegowda; Şenyel, Mustafa (Pergamon-Elsevier Science LTD, 2015)Molecular structure and properties of 1-(2-hydroxy-4,5-dimethylphenyl)ethanone were experimentally investigated by X-ray diffraction technique and vibrational spectroscopy. Experimental results on the molecular structure ... -
DFT, FT-Raman and FT-IR investigations of 1-cyclobutylpiperazine
Bağlayan, Özge; Kaya, Mehmet Fatih; Parlak, Cemal; Şenyel, Mustafa (Pergamon-Elsevier Science LTD, 2012)FT-IR and FT-Raman spectra of 1-cyclobutylpiperazine (1cbpp) have been experimentally reported in the region of 4000-10 cm(-1) and 4000-50 cm(-1), respectively. The optimized geometric parameters, conformational equilibria, ... -
Dft/Tddft Investigation on the Electronic Structures and Spectral Characteristics of C5H3Xos (X = H, F, Cl Or Br)
Güneş, E.; Parlak, Cemal; Şenyel, Mustafa (Maik Nauka/Interperiodica/Springer, 2017)Halogen and solvent effects on the conformational, vibrational, and electronic characteristics of thiophene-2-carbaldehyde (T2C, C5H4OS) and thiophene-2-carbonyl-halogens [C5H3XOS, X = F (T2C-F), Cl (T2C-Cl), and Br (T2C-Br)] ... -
Experimental and theoretical NMR study of 4-(3-cyclohexen-1-yl)pyridine
Parlak, Cemal; Alver, Özgür; Şenyel, Mustafa (Pergamon-Elsevier Science LTD, 2008)H-1, C-13, DEPT, COSY, NOESY and HETCOR NMR spectra of 4-(3-cyclohexen-1-yl)pyridine (4-Chpy) have been reported for the first time. H-1 and C-13 NMR chemical shifts of 4-Chpy (C11H13N) have been calculated by means of the ... -
FT-IR and NMR investigation of 1-phenylpiperazine: A combined experimental and theoretical study
Alver, Özgür; Parlak, Cemal; Şenyel, Mustafa (Pergamon-Elsevier Science LTD, 2007)FF-IR and H-1, C-13, DEPT, COSY, NOESY, HETCOR, INADEQUATE NMR spectra of 1-phenylpiperazine (pp) have been reported for the first time except for its H-1 NMR spectrum. The vibrational frequencies and H-1, C-13 NMR chemical ... -
FT-IR and NMR investigation of 2-(1-cyclohexenyl)ethylamine: A combined experimental and theoretical study
İzgi, Tekin; Alver, Özgür; Parlak, Cemal; Aytekin, M. T.; Şenyel, Mustafa (Pergamon-Elsevier Science LTD, 2007)FT-IR and H-1, C-13, DEPT, HETCOR, COSY, and NOESY NMR spectra of 2-(1-cyclohexenyl)ethylamine (CyHEA) have been reported for the first time. The vibrational frequencies and H-1, C-13 NMR chemical shifts of CyHEA (C8H15N) ... -
FT-IR and Raman spectroscopic and quantum chemical investigations of some metal halide complexes of 1-phenylpiperazine
Keşan, Gürkan; Bağlayan, Özge; Parlak, Cemal; Alver, Özgür; Şenyel, Mustafa (Pergamon-Elsevier Science LTD, 2012)New metal halide complexes in the form of M(pp)(2)Cl-2 (where pp = 1-phenylpiperazine and M = Pd or Hg) have been prepared for the first time and their FT-IR and FT-Raman spectra are reported in the region of 4000-10 cm(-1) ... -
FT-IR spectroscopic investigation of some Hofmann type complexes: M(1-phenylpiperazine)(2)Ni(CN)(4) (M = Ni, Co, Cd, Pd or Mn)
Şenyel, Mustafa; Parlak, Cemal; Alver, Özgür (Pergamon-Elsevier Science LTD, 2008)New Hofmann type complexes in the form of M(pp)(2)Ni(CN)(4) (where pp = 1-phenylpiperazine and M = Ni, Co, Cd, Pd or Mn) have been prepared in powder form and their infrared spectra have been reported in the range of ... -
FT-IR spectroscopic investigation of some Hofmann type complexes: M(2-(1-Cyclohexenyl)ethylamine)(2)Ni(CN)(4) (M = Ni, Co)
İzgi, Tekin; Parlak, Cemal; Aytekin, Türkay; Şenyel, Mustafa (Elsevier Science BV, 2008)New Hofmann type complexes in the form of M(CyHEA)(2)Ni(CN)(4) (where CyHEA = 2-(1-cyclohexenyl)ethylamine; M = Ni or Co) have been prepared in powder form and their infrared spectra have been reported in the range of ... -
FT-IR spectroscopic study of the Hofmann-T-d-type clathrates: Ni(1,9-diaminononane)M'(CN)(4).2G (M' = Cd or Hg, G = benzene, 1,2-dichlorobenzene or 1,4-dichlorobenzene)
Kartal, Zeki; Parlak, Cemal; Şentürk, Şükrü; Aytekin, Meryem Türkay; Şenyel, Mustafa (Croatian Chemical Soc, 2007)New Hofmann T-d-type clathrates in the form of Ni(1,9-diaminononane)M'(CN)(4) center dot 2G (M' = Cd or Hg, G = benzene, 1,2-dichlorobenzene or 1,4-dichlorobenzene) were prepared in powder form and their infrared spectra ...
