On the origin of dinitrogen hydrogenation promoted by [(η5- C5Me4H)2Zr]2(μ2, η2,η2-N2)

Medicine & Life Sciences

• Hydrogenation 100%
• Zirconocene dichloride 91%
• Zirconium 62%
• Nitrogen 59%
• Density Functional Theory 35%
• Ligands 28%

Engineering & Materials Science

• Hydrogenation 75%
• Nitrogen 55%
• Ligands 53%
• Zirconium 50%
• Dihedral angle 31%
• Ground state 30%
• Density functional theory 29%
• Labeling 19%

Chemical Compounds

• Dinitrogen 72%
• Zirconocene 51%
• Hydrogenation 44%
• Nitrogen 36%
• Ligand 17%
• Dihedral Angle 16%
• Ground State 15%
• Density Functional Theory 12%