dc.contributor.author | Gunsel, Armagan | |
dc.contributor.author | Bilgicli, Ahmet T. | |
dc.contributor.author | Tuzun, Burak | |
dc.contributor.author | Piskin, Hasan | |
dc.contributor.author | Atmaca, Goknur Yasa | |
dc.contributor.author | Erdogmus, Ali | |
dc.contributor.author | Yarasir, M. Nilufer | |
dc.date.accessioned | 2019-07-27T12:10:23Z | |
dc.date.accessioned | 2019-07-28T09:37:09Z | |
dc.date.available | 2019-07-27T12:10:23Z | |
dc.date.available | 2019-07-28T09:37:09Z | |
dc.date.issued | 2019 | |
dc.identifier.issn | 1010-6030 | |
dc.identifier.uri | https://dx.doi.org/10.1016/j.jphotochem.2018.12.038 | |
dc.identifier.uri | https://hdl.handle.net/20.500.12418/5951 | |
dc.description | WOS: 000458225200009 | en_US |
dc.description.abstract | This work presents the synthesis of 4-(2-(ethyl(m-tolyl) amino) ethoxy) phthalonitrile (1) as ligand and its peripherally tetrasubstituted metal-free (2) and metallophthalocyanines (3-5) derivatives. Synthesized compounds were characterized by standart spectroscopy methods. The molecular structure of the ligand (1) was confirmed by single-crystal X-ray diffraction experiment. The crystallographic information file (cif) was uploaded to the data center with CCDC number 1,853,485. The optimized structure of the ligand (1) and the phthalocyanines (2-5) were obtained by using different metods such as B3lyp, HF and m062x method 3-21 g, 6-31 g, sdd basis set. In b3lyp/6-31 + + g(d,p) basis set, H-1 and C-13 NMR chemical shifts, IR spectrum and UV-vis spectrum were measured in gas, chloroform and dimethylsulfoxide phase by means of the obtained optimized structure. Besides, the photophysical and photochemical properties of newly synthesized phthalocyanines (2-5) were investigated in DMSO, comparatively. Singlet oxygen quantum yields of the phthalocyanines (2-5) are ranging from 0.28 to 0.70. | en_US |
dc.description.sponsorship | Sakarya University [BAP-2017-02-04-013] | en_US |
dc.description.sponsorship | We thank The Research Fund of Sakarya University (Project no: BAP-2017-02-04-013). This research was made possible by TUBITAK ULAKBIM, High Performance and Grid Computing Center (TR-Grid e-Infrastructure). | en_US |
dc.language.iso | eng | en_US |
dc.publisher | ELSEVIER SCIENCE SA | en_US |
dc.relation.isversionof | 10.1016/j.jphotochem.2018.12.038 | en_US |
dc.rights | info:eu-repo/semantics/closedAccess | en_US |
dc.subject | Phthalocyanine | en_US |
dc.subject | Synthesis | en_US |
dc.subject | Computational studies | en_US |
dc.subject | Crystal structure | en_US |
dc.subject | Photochemistry | en_US |
dc.title | Synthesis of tetra-substituted phthalocyanines bearing 2-(ethyl(m-tolyl) amino)ethanol: Computational and photophysicochemical studies | en_US |
dc.type | article | en_US |
dc.relation.journal | JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY | en_US |
dc.contributor.department | [Gunsel, Armagan -- Bilgicli, Ahmet T. -- Yarasir, M. Nilufer] Sakarya Univ, Dept Chem, TR-54187 Esentepe, Sakarya, Turkey -- [Tuzun, Burak] Cumhuriyet Univ, Dept Chem, TR-58140 Sivas, Turkey -- [Piskin, Hasan] Gebze Inst Technol, Dept Phys, TR-41400 Gebze, Kocaeli, Turkey -- [Atmaca, Goknur Yasa -- Erdogmus, Ali] Yildiz Tech Univ, Dept Chem, TR-34210 Istanbul, Turkey | en_US |
dc.contributor.authorID | BILGICLI, Ahmet Turgut -- 0000-0002-4144-7357; GUNSEL, ARMAGAN -- 0000-0003-1965-1017; Yarasir, Meryem Nilufer -- 0000-0002-7327-7137 | en_US |
dc.identifier.volume | 373 | en_US |
dc.identifier.endpage | 86 | en_US |
dc.identifier.startpage | 77 | en_US |
dc.relation.publicationcategory | Makale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı | en_US |