Open AccessTheoretical simulation for the [6-p-cymene)RuCl2(meapy)] complex
Author(s) -
José V. Dos Santos,
Sérgio Ricardo de Lázaro,
Luis H. S. Lacerda,
Rosane Aparecida Ribeiro,
Flávia Marszaukowski,
Ivelise Dimbarre Lao Guimarães,
Karen Wohnrath,
Renè T. Boeré
Publication year - 2020
Language(s) - English
Resource type - Conference proceedings
DOI - 10.21826/viiiseedmol2020196
Subject(s) - ruthenium , solvation , solvent , molecular orbital , chemistry , energy minimization , computational chemistry , platinum , atomic orbital , virtual screening , cytotoxicity , electronic structure , computer science , molecular dynamics , molecule , organic chemistry , physics , biochemistry , catalysis , quantum mechanics , electron , in vitro