Scavenger mechanism of methylglyoxal by metformin. A DFT study

Keyphrases

• Reaction Mechanism 100%
• Scavenger 100%
• Tautomerism 100%
• DFT Study 100%
• Metformin 100%
• Methylglyoxal 100%
• Dehydration 50%
• Hydrogen Bond Network 50%
• Tautomers 50%
• Rate-determining Step 50%
• Energy Value 50%
• Zwitterion 50%
• Density Functional Calculations 50%
• Explicit Water 50%
• Ring Closure 50%
• Overall Activation Energy 50%
• Five Steps 50%
• Intramolecular Proton Transfer 50%
• Water Solvent 50%
• Triazepine 50%

Chemistry

• Density Functional Theory 100%
• Tautomerization 100%
• Methylglyoxal 100%
• Metformin 100%
• Reaction Activation Energy 50%
• Hydrogen Bonding 50%
• Proton Transfer 50%
• Tautomer 50%
• Rate-Determining Step 50%
• Calorific Value 50%