| Synthesis, crystal structure, vibrational spectral investigation, intermolecular interactions, chemical reactivity, NLO properties and molecular docking analysis on (E)-N-(4 … AR Guerroudj, N Boukabcha, A Benmohammed, N Dege, NEH Belkafouf, ... Journal of Molecular Structure 1240, 130589, 2021 | 47 | 2021 |
| Crystal structure, Hirshfeld surface analysis and computational studies of thiazolidin-4-one derivative:(Z)-5-(4-Chlorobenzylidene)-3-(2-ethoxyphenyl)-2-thioxothiazolidin-4-one N Khelloul, K Toubal, N Benhalima, R Rahmani, A Chouaih, A Djafri, ... Acta Chim. Slov 63, 619-626, 2016 | 23 | 2016 |
| Spectral investigation, TD-DFT study, Hirshfeld surface analysis, NCI-RDG, HOMO-LUMO, chemical reactivity and NLO properties of 1-(4-fluorobenzyl)-5-bromolindolin-2, 3‑dione N Boukabcha, A Benmohammed, MHM Belhachemi, M Goudjil, ... Journal of Molecular Structure 1285, 135492, 2023 | 17 | 2023 |
| Experimental spectral characterization, Hirshfeld surface analysis, DFT/TD-DFT calculations and docking studies of (2Z, 5Z)-5-(4-nitrobenzylidene)-3-N (2-methoxyphenyl)-2-N’(2 … A Djafri, F Perveen, N Benhalima, N Khelloul, R Rahmani, A Djafri, ... Heliyon 6 (12), 2020 | 15 | 2020 |
| Synthesis, structural, spectroscopic, intermolecular interactions, kinetic stability, charge transfer method with DNA bases and electronic properties of (E)-3-(2-ethoxyphenyl … A Nekrouf, K Toubal, Y Megrouss, NEH Belkafouf, A Djafri, N Khelloul, ... Journal of Molecular Structure 1262, 133002, 2022 | 12 | 2022 |
| Synthesis, crystallographic and spectroscopic investigation, chemical reactivity, hyperpolarizabilities and in silico molecular docking study of (Z)-2N-(tert‑butylimino)-3N’-(4 … FZ Boudjenane, F Triki-Baara, N Boukabcha, NEH Belkafouf, N Dege, ... Journal of Molecular Structure 1287, 135620, 2023 | 8 | 2023 |
| Synthesis, structural determination, Hirshfeld surface analysis, 3D energy frameworks, electronic and (static, dynamic) NLO properties of o-Nitroacetanilide (o-NAA): A combined … N Boukabcha, A Direm, M Drissi, Y Megrouss, N Khelloul, N Dege, ... Inorganic Chemistry Communications 133, 108884, 2021 | 7 | 2021 |
| FTIR, NMR and UV–visible spectral investigations, theoretical calculations, topological analysis, chemical stablity, and molecular docking study on novel bioactive compound … R Rahmani, F Perveen, N Benhalima, A Djafri, N Khelloul, A Chouaih, ... Polycyclic Aromatic Compounds 43 (5), 4685-4706, 2023 | 6 | 2023 |
| 2-thioxo-3N-(2-ethoxyphenyl)-5 [4′-methyl-3′ N-(2′-ethoxyphenyl) thiazol-2′(3′ H)-ylidene] thiazolidin-4-one: Growth, spectroscopic behavior, single-crystal investigation … N Khelloul, K Toubal, N Boukabcha, N Dege, A Djafri, NEH Belkafouf, ... Phosphorus, Sulfur, and Silicon and the Related Elements 198 (3), 199-214, 2023 | 5 | 2023 |
| Structural characterization, molecular docking assessment, drug-likeness study and DFT investigation of 2-(2-{1, 2-dibromo-2-[3-(4-chloro-phenyl)-[1, 2, 4] oxadiazol-5-yl]-2 … S Yahiaoui, Y Megrouss, N Boukabcha, NEH Belkafouf, N Khelloul, ... Journal of the Indian Chemical Society 99 (11), 100745, 2022 | 2 | 2022 |
| Molecular and crystal structure, Hirshfeld analysis and DFT investigation of 5-(furan-2-ylmethylidene) thiazolo [3, 4-a] benzimidazole-2-thione H Khaldi, A Djafri, Y Megrouss, N Khelloul, A Chouaih Acta Crystallographica Section E: Crystallographic Communications 76 (12 …, 2020 | 2 | 2020 |
| Electronic properties and nonlinear optical response of praziquantel hemihydrate and its derivatives: characterization via DFT, AIM, and RDG analysis N Benhalima, F Yahia Cherif, B Doumi, N Khelloul, O Kourat, A Chouaih, ... Journal of Optics, 1-19, 2024 | | 2024 |
| ethoxyphenyl) thiazol-2′(3′ H)-ylidene] thiazolidin-4-one: Growth, spectroscopic behavior, single-crystal investigation, Hirshfeld surface analysis, DFT/TD-DFT computational … N Khelloul, K Toubal, N Boukabcha, N Dege, A Djafri, NEH Belkafouf, ... | | |
