A theoretical investigation into the impact of solvents (alkanolic and non-alkanolic), structural and spectroscopic properties, donor-acceptor insights, Hirshfeld surface, and molecular docking of the anti-tumor compound (2E)-3-[4-(dimethylamino)phenyl]-1-(3-nitrophenyl)prop‑2-en-1-one

Autor: Kumar, A. Ram, Selvaraj, S., Vickram, A.S., Thirunavukkarasu, M., Samdani, Mohammad Shahzad, SD, Priya, Balu, Ranjith
Zdroj: In Journal of Molecular Structure 25 February 2025 1323
Databáze: ScienceDirect