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  1. Unravelling the structure and reactivity of N,O-heterocycles: a multifaceted quantum chemical approach using a benzoxazole derivative as a case study

    Article • Journal of Chemical Sciences, October 2024, Springer Science + Business Media

    Professor Taha GUERFEL

  2. Noncovalent interactions between quinoxalines and protoporphyrinogen oxidase (PPO): a computational case study for herbicidal applications

    Article • Chemical Papers, May 2024, Springer Science + Business Media

    Dr Melek Hajji, Professor Taha GUERFEL

  3. Regioselective synthesis, structural and bioactivity of acetylated 1,5-benzodiazepin-2-one derivatives — X-ray crystallography, DFT and molecular docking approaches

    Article • Journal of Molecular Structure, January 2024, Elsevier

    Dr Melek Hajji, Professor Taha GUERFEL

  4. The Unconventional Noncovalent Interactions Control: Crystallographic and Theoretical Analyses of the Crystalline Structure of 1,1′‐(1‐Chloro‐4‐methoxyphenyl)dibenzene as a Case Study

    Article • ChemistrySelect, September 2023, Wiley

    Dr Melek Hajji, Professor Taha GUERFEL

  5. Synthesis, non-covalent interactions and chemical reactivity of 1-pentyl-3-phenylquinoxalin-2(1H)-one — Structural and computational studies

    Article • Journal of Molecular Structure, August 2023, Elsevier

    jihad sebhaoui, Dr Melek Hajji, Professor Taha GUERFEL

  6. A combined experimental and quantum chemical analysis of 3,3′-diaminodipropylamine–dihydrogenphosphate hybrid compound: [H 3 (C 6 H 17 N ...

    Article • Molecular Crystals and Liquid Crystals, July 2023, Taylor & Francis

    Dr Melek Hajji, Professor Taha GUERFEL

  7. Structural, physico-chemical analyses, Hirshfeld surface, and DFT calculations of a mixed phosphate-based compound templated by 4-dimethylaminopyridine (C7H11N2)2H2P2O7.H...

    Article • Molecular Crystals and Liquid Crystals, April 2023, Taylor & Francis

    Dr Melek Hajji, Professor Taha GUERFEL

  8. Study of structural, dielectric, and optical properties of Ni0.4Cu0.4Co0.2Fe2O4 spinel ferrite for electrical and optical applications

    Article • Journal of Materials Science Materials in Electronics, September 2022, Springer Science + Business Media

    Professor Taha GUERFEL

  9. Sol–Gel Synthesis and Characterizations for La0.7Ca0.15Pb0.15CoO3 Perovskite Cobaltite for Optical and Magnetic Applications

    Article • Journal of Low Temperature Physics, July 2022, Springer Science + Business Media

    Professor Taha GUERFEL

  10. Synthesis, Thermal Properties and Electrical Conductivity of Na-Sialate Geopolymer

    Article • Journal of Inorganic and Organometallic Polymers and Materials, April 2022, Springer Science + Business Media

    Professor Taha GUERFEL

  11. Synthesis, Thermal properties and electrical conductivity of Na-Sialate geopolymer

    Article • February 2022, Research Square

    Professor Taha GUERFEL

  12. Computational chemistry methods for modelling non-covalent interactions and chemical reactivity— An overview

    Article • Journal of the Indian Chemical Society, November 2021, Elsevier

    Professor Taha GUERFEL, Dr Melek Hajji

  13. Non-covalent assembly of β-iminoamine-chlorocobaltate(II) hybrid material: Molecular structure, computational simulations and antimicrobial activity

    Article • Journal of Molecular Structure, November 2021, Elsevier

    Professor Taha GUERFEL, Dr Melek Hajji

  14. Spectroscopic, Electrochemical, Magnetic and Structural Characterization of an Hexamethylenetetramine Co(II) Porphyrin Complex – Application in the Catalytic Degradation of Vat Yellow 1 dye

    Article • Journal of Molecular Structure, May 2021, Elsevier

    Professor Taha GUERFEL, Dr Melek Hajji

  15. Structural and computational analyses of a 2-propanolammonium-chlorocadmate(II) assembly: Pivotal role of hydrogen bonding and H—H interactions

    Article • Journal of Molecular Structure, January 2021, Elsevier

    Professor Taha GUERFEL, Dr Melek Hajji

  16. Neutral nickel(II) complex bearing hemilabile N,S-donor ligands – structural, Hirshfeld surfaces and DFT studies

    Article • Molecular Crystals and Liquid Crystals, September 2020, Taylor & Francis

    Professor Taha GUERFEL, Dr Melek Hajji

  17. Experimental and computational studies on the structure and properties of a novel low-spin iron(III) macrocyclic complex

    Article • Molecular Crystals and Liquid Crystals, May 2020, Taylor & Francis

    Professor Taha GUERFEL, Dr Melek Hajji

  18. Heteroleptic cobalt(II) complex with nitrogen-rich macrocycles — Structure, bioactivity and DFT modelling

    Article • Solid State Sciences, February 2020, Elsevier

    Professor Taha GUERFEL, Dr Melek Hajji

  19. Synthesis and structural studies of hexafluorophosphate-based organic salts: A combined experimental and computational analysis

    Article • Journal of Molecular Structure, February 2020, Elsevier

    Professor Taha GUERFEL, Dr Melek Hajji

  20. A newly synthesized nitrogen‐rich derivative of bicyclic quinoxaline—Structural and conceptual DFT reactivity study

    Article • Journal of Physical Organic Chemistry, January 2020, Wiley

    Prof. Youssef Ramli, Professor Taha GUERFEL, Dr Melek Hajji

  21. Synthesis, structure and theoretical simulation of a zinc(II) coordination complex with 2,3-pyridinedicarboxylate

    Article • Journal of Molecular Structure, January 2020, Elsevier

    Professor Taha GUERFEL, Dr Melek Hajji

  22. Synthesis, structure, photophysical properties and biological activity of a cobalt(II) coordination complex with 4,4′-bipyridine and porphyrin chelating ligands

    Article • Journal of Saudi Chemical Society, November 2019, Elsevier

    Professor Taha GUERFEL, Dr Melek Hajji

  23. Crystallographic and first‐principles density functional theory study on the structure, noncovalent interactions, and chemical reactivity of 1,5‐benzodiazepin‐2‐ones derivatives

    Article • International Journal of Quantum Chemistry, June 2019, Wiley

    Professor Taha GUERFEL, Dr Melek Hajji

  24. A new high-spin iron(III) bis(aqua) complex with the meso-tetra(para-chlorophenyl)porphyrin: X-ray crystallography, Hirshfeld surface analysis, magnetic, EPR and electrochemical properties

    Article • Research on Chemical Intermediates, August 2018, Springer Science + Business Media

    Professor Taha GUERFEL, Dr Melek Hajji

  25. Modelling, structural, thermal, optical and vibrational studies of a new organic–inorganic hybrid material (C5H16N2)Cd1.5Cl5

    Article • Bulletin of Materials Science, February 2017, Springer Science + Business Media

    Professor Taha GUERFEL, Dr Melek Hajji

  26. Synthesis, structure, spectroscopic investigations, and computational studies of optically pure β-ketoamide

    Article • Crystallography Reports, November 2016, Pleiades Publishing Ltd

    Professor Taha GUERFEL

  27. Crystal structure of 2-isopropyl-5,7′-dimethyl-1′,3′,3a',6′,8a',8b'-hexahydrospiro[cyclohexane-1,6′-furo[3,4-d]imidazo[1,5-b]isoxazol]-8′(7′H)-one

    Article • Acta Crystallographica Section E Crystallographic Communications, July 2016, International Union of Crystallography

    Professor Taha GUERFEL

  28. Two New Coordination Compounds Based on Polymeric, [CdCl3O] n n− Chains or [Cd2.5Cl7O2] n 2n− Layers: Synthesis, Crystal Structures, Physico-Chemical Properties and Theoretical Calculations

    Article • Journal of Cluster Science, April 2016, Springer Science + Business Media

    Professor Taha GUERFEL, Dr Melek Hajji

  29. Crystal structure, vibrational studies, optical properties and TG-DTA investigations of a new chlorocadmate templated by 1-methylimidazolium

    Article • Chemical Research in Chinese Universities, March 2016, Springer Science + Business Media

    Professor Taha GUERFEL, Dr Melek Hajji

  30. Crystal structure, phase transitions, and IR spectroscopic investigations of a new sulfate templated by diethylene triammonium

    Article • Phosphorus Sulfur and Silicon and the Related Elements, January 2016, Taylor & Francis

    Professor Taha GUERFEL, Dr Melek Hajji

  31. Synthesis, Crystal Structure, Vibrational Spectra, Optical Properties and Thermal Analysis of a New Chlorocadmate Templated by 1-(2-Ammoniumethyl) Piperazinium

    Article • Journal of Inorganic and Organometallic Polymers and Materials, April 2014, Springer Science + Business Media

    Professor Taha GUERFEL, Dr Melek Hajji

  32. Crystal Structure, Thermal Analysis, IR and Raman Spectroscopic Investigations of (C8H22N2)(AsO2(OH)2)2

    Article • Journal of Inorganic and Organometallic Polymers and Materials, July 2013, Springer Science + Business Media

    Professor Taha GUERFEL

  33. ChemInform Abstract: Chemo- and Regioselective 1,3-Dipolar Cycloaddition of 2-Diazopropane over 1,4-Benzoquinone: Synthesis of New Pyrazoloquinones.

    Article • ChemInform, May 2013, Wiley

    Professor Taha GUERFEL

  34. Chemo- and Regioselective 1,3-Dipolar Cycloaddition of 2-Diazopropane over 1,4-Benzoquinone: Synthesis of New Pyrazoloquinones

    Article • Synthetic Communications, February 2013, Taylor & Francis

    Professor Taha GUERFEL

  35. Crystal Structure and Physicochemical Properties of 2-Diisopropylammonium Ethylammonium Sulfate Dihydrate

    Article • Crystal Structure Theory and Applications, January 2012, Scientific Research Publishing, Inc,

    Professor Taha GUERFEL

  36. Crystal structure, thermal analysis and IR spectroscopic investigation of bis (N-methyl anilinium) sulfate

    Article • Open Journal of Inorganic Chemistry, January 2011, Scientific Research Publishing, Inc,

    Professor Taha GUERFEL

  37. Synthesis and structure of heterodifunctional N,O ligands

    Article • Comptes Rendus Chimie, March 2009, Elsevier

    Professor Taha GUERFEL

  38. Synthesis and structure of new cationic methallyl molybdenum(II) complexes supported by α-diimine ligands

    Article • Polyhedron, February 2009, Elsevier

    Professor Taha GUERFEL

  39. 2,2-Bis(3-chloromethyl-4-ethoxyphenyl)propane

    Article • Acta Crystallographica Section E Structure Reports Online, June 2008, International Union of Crystallography

    Professor Taha GUERFEL

  40. Synthesis and structure of the unsymmetrical β-diimine precursor: The β-iminoamine

    Article • Comptes Rendus Chimie, June 2008, Elsevier

    Professor Taha GUERFEL

  41. Synthesis and X-ray structure of cationic methallyl palladium complexes supported by unsymmetrical β-diimine ligands

    Article • Polyhedron, February 2008, Elsevier

    Professor Taha GUERFEL

  42. Crystal structure and physicochemical properties of a new organic condensed phosphate (C7H10NO)3P3O9·4H2O

    Article • Materials Research Bulletin, March 2007, Elsevier

    Professor Taha GUERFEL

  43. Crystal structures, thermal analysis and IR investigations of (C4H14N2O)SO4 and (C4H14N2O)SO4·H2O

    Article • Materials Research Bulletin, January 2007, Elsevier

    Professor Taha GUERFEL

  44. Crystal structure, thermal analysis and IR spectrometric investigation of l-tyrosine hydrazide diphosphate monohydrate

    Article • Materials Research Bulletin, November 2006, Elsevier

    Professor Taha GUERFEL

  45. Synthesis and X-Ray Analysis of a New [6]Helicene.

    Article • ChemInform, October 2006, Wiley

    Professor Taha GUERFEL

  46. Synthesis, characterization and crystal structure of diamagnetic tetracoordinated chromium (II) complexes supported by α-diimine ligands

    Article • Inorganic Chemistry Communications, October 2006, Elsevier

    Professor Taha GUERFEL

  47. Synthesis and X‐Ray Analysis of a New [6]Helicene

    Article • Synthetic Communications, June 2006, Taylor & Francis

    Professor Taha GUERFEL

  48. Crystal structure, thermal analysis and IR spectrometric investigation of bis (2-amino-6-methyl) pyridinium sulfate

    Article • Crystal Research and Technology, April 2006, Wiley

    Professor Taha GUERFEL

  49. Preparation and structural characterization of tetracoordinated tungsten(II) diazadiene complexes

    Article • Journal of Organometallic Chemistry, April 2006, Elsevier

    Professor Taha GUERFEL

  50. Synthesis and crystal structure of tetracoordinated molybdenum (II) complexes containing rigid α-diimine ligands

    Article • Polyhedron, March 2006, Elsevier

    Professor Taha GUERFEL

  51. Crystal structure, thermal analysis, and IR spectroscopic investigation of bis(2-amino-6-methyl) pyridinium sulfate

    Article • Journal of Chemical Crystallography, July 2005, Springer Science + Business Media

    Professor Taha GUERFEL

  52. Crystal structure, thermal analysis and IR spectrometric investigation of L-tyrosine hydrazide sulfate

    Article • Solid State Sciences, December 2001, Elsevier

    Professor Taha GUERFEL

  53. Article • Journal of Chemical Crystallography, January 2001, Springer Science + Business Media

    Professor Taha GUERFEL

  54. Article • Journal of Chemical Crystallography, January 2000, Springer Science + Business Media

    Professor Taha GUERFEL

  55. Article • Journal of Chemical Crystallography, January 2000, Springer Science + Business Media

    Professor Taha GUERFEL

  56. Article • Journal of Chemical Crystallography, January 2000, Springer Science + Business Media

    Professor Taha GUERFEL

  57. Article • Journal of Chemical Crystallography, January 1999, Springer Science + Business Media

    Professor Taha GUERFEL