Synthesis, spectroscopy, crystal structure, TGA/DTA study, DFT and molecular docking investigations of (E)-4-(4-methylbenzyl)-6-styrylpyridazin-3 (2H)-one F El Kalai, EB Çınar, CH Lai, S Daoui, T Chelfi, M Allali, N Dege, ... Journal of Molecular Structure 1228, 129435, 2021 | 65 | 2021 |
Synthesis, Crystal Structure, Supramolecular Assembly Inspection by Hirshfeld Surface Analysis and Computational Exploration of 4-Phenyl-6-(p-Tolyl) Pyrimidin-2 (1 H)-One (PPTP) M Kurbanova, M Ashfaq, MN Tahir, A Maharramov, N Dege, ... Journal of Structural Chemistry 64 (3), 437-449, 2023 | 28 | 2023 |
Synthesis, structural, spectroscopic, hirshfeld surface analysis and computational study of copper complex containing salicylaldimine ligands E Alaman, AA Ağar, MN Tahir, M Ashfaq, EB Poyraz, N Dege Journal of Structural Chemistry 64 (7), 1314-1328, 2023 | 24 | 2023 |
Crystal structure and Hirshfeld surface analysis of dimethyl 3, 3′-{[(1E, 2E)-ethane-1, 2-diylidene] bis (azanylylidene)} bis (4-methylbenzoate) S Yeşilbağ, EB Çınar, N Dege, E Ağar, E Saif Structure Reports 78 (4), 340-345, 2022 | 14 | 2022 |
Investigation on crystal structure, spectral FT-IR analysis, DFT and molecular docking studies of a novel complex with the N′-(pyridin-2-ylmethylene) nicotinohydrazide G Mahmoudi, S Sahli, Ö Tamer, EB Çınar, U Böhme, N Dege, CB Nasr, ... Journal of Molecular Structure 1269, 133741, 2022 | 11 | 2022 |
Designing of two new cadmium (II) complexes as bio-active materials: Synthesis, X-ray crystal structures, spectroscopic, DFT, and molecular docking studies AAB OmarAli, RK Ahmed, AJM Al-Karawi, S Marah, S Kansız, Y Sert, ... Journal of Molecular Structure 1290, 135974, 2023 | 10 | 2023 |
Crystal structure, Hirshfeld surface analysis and DFT studies of 6-[(E)-2-(thiophen-2-yl) ethenyl]-4, 5-dihydropyridazin-3 (2H)-one S Daoui, EB Çınar, F El Kalai, R Saddik, N Dege, K Karrouchi, N Benchat Acta Crystallographica Section E: Crystallographic Communications 75 (12 …, 2019 | 10 | 2019 |
Synthesis, crystal structure, DFT, Hirshfeld surface analysis, energy framework, docking and molecular dynamic simulations of (E)-4-(4-methylbenzyl)-6-styrylpyridazin-3 (2H … F El Kalai, EB Çınar, Y Sert, M Alhaji Isa, CH Lai, F Buba, N Dege, ... Journal of Biomolecular Structure and Dynamics 41 (21), 11578-11597, 2023 | 9 | 2023 |
Crystal structure and Hirshfeld surface analysis of 4-(2, 6-dichlorobenzyl)-6-[(E)-2-phenylethenyl] pyridazin-3 (2H)-one S Daoui, EB Cinar, N Dege, T Chelfi, F El Kalai, A Abudunia, K Karrouchi, ... Acta Crystallographica Section E: Crystallographic Communications 77 (1), 23-27, 2021 | 9 | 2021 |
Deciphering non-covalent interactions in unprecedented binuclear copper complex: spectroscopic, Hirshfeld surface and DFT investigation SK Yilmaz, AA Agar, EB Cinar, N Dege, VG Vidya, VGV Kumar Journal of Molecular Structure 1299, 137111, 2024 | 8 | 2024 |
Growth, theory and practice-based studies of 2, 2′, 2 ″-nitrilotris ((E)-1-(2-hydroxyphenyl)-N-ethylmethanimine) manganese (III) crystals for electronic filters, opto … S Lavanya, N Dege, EB Poyraz, K SenthilKannan Journal of Materials Science: Materials in Electronics 35 (4), 315, 2024 | 8 | 2024 |
Designing of eight-coordinate manganese (II) complexes as bio-active materials: Synthesis, X-ray crystal structures, spectroscopic, DFT, and molecular docking studies RK Ahmed, AAB OmarAli, AJM Al-Karawi, S Marah, MI Jaafar, N Dege, ... Polyhedron 244, 116606, 2023 | 8 | 2023 |
Crystal structure, Hirshfeld surface analysis and DFT studies of (E)-4-methyl-2-{[(2-methyl-3-nitrophenyl) imino] methyl} phenol EB Cinar, MSH Faizi, NK Yagci, OE Dogan, AS Aydin, E Agar, N Dege, ... Acta Crystallographica Section E: Crystallographic Communications 76 (10 …, 2020 | 8 | 2020 |
Crystal structure and Hirshfeld surface analysis of 4-(4-methylbenzyl)-6-phenylpyridazin-3 (2H)-one S Daoui, EB Cinar, F El Kalai, R Saddik, K Karrouchi, N Benchat, ... Acta Crystallographica Section E: Crystallographic Communications 75 (9 …, 2019 | 8 | 2019 |
Crystal structure and Hirshfeld surface analysis of 2, 4, 6-triaminopyrimidine-1, 3-diium dinitrate S Dilshad, EB Çınar, A Ali, A Ahmed, MJ Alam, M Ahmad, A Ahmad, ... Acta Crystallographica Section E: Crystallographic Communications 78 (6 …, 2022 | 7 | 2022 |
A quinoline-benzotriazole derivative: Synthesis, crystal structure and characterization by using spectroscopic, DFT and molecular docking methods B Himmi, SA Brandán, Y Sert, AA Kawther, N Dege, EB Cinar, A El Louzi, ... Results in Chemistry 5, 100916, 2023 | 6 | 2023 |
Synthesis, crystal structure, static and dynamic properties, molecular structure, reactive sites, wavefunction and molecular docking of 1-(3-((4-(diethylamino)-2 … KP Begaum, T Prabhu, S Kaleeswaran, S Kadaikunnan, G Abbas, ... Journal of Molecular Structure 1294, 136348, 2023 | 5 | 2023 |
Crystal structure, Hirshfeld surface analysis and DFT studies of (E)-2-{[(3-chloro-4-methylphenyl) imino] methyl}-4-methylphenol MSH Faizi, EB Cinar, AS Aydin, E Agar, N Dege, A Mashrai Acta Crystallographica Section E: Crystallographic Communications 76 (8 …, 2020 | 5 | 2020 |
Crystal structure and Hirshfeld surface analysis of 6-((E)-2-{4-[2-(4-chlorophenyl)-2-oxoethoxy] phenyl} ethenyl)-4, 5-dihydropyridazin-3 (2H)-one S Daoui, I Muwafaq, EB Çınar, A Abudunia, N Dege, N Benchat, ... Acta Crystallographica Section E: Crystallographic Communications 78 (1), 8-11, 2022 | 4 | 2022 |
Structural, Spectroscopic and Molecular Characterization of an Asymmetric Schiff Base Compound OE Doğan, EB Poyraz, H Saraçoğlu, T Ağar, B Yaşa, N Dege Journal of Structural Chemistry 64 (6), 1147-1163, 2023 | 3 | 2023 |