Experimental and theoretical investigations for novel 6-nitroquinoxaline-2,3‑dione derivatives: Synthesis, characterization, DFT calculations, ADME analysis, hirshfeld surface calculations, molecular docking studies, and antiproliferation evaluation

Chemistry

• Density Functional Theory 100%
• Hirshfeld Surface 100%
• 13C NMR Spectroscopy 50%
• DFT-B3LYP Calculation 50%
• Density Functional Theory 50%
• Single-Crystal X-Ray Crystallography 50%
• Spectroscopy 50%
• Hydrogen Chloride 50%
• UV/VIS Spectroscopy 50%
• Phenylenediamine 50%
• Molecular Orbital 50%
• Halide 50%
• Antiproliferative 50%
• Oxalic Acid 50%