Vibrational frequency analysis, FT-IR, DFT and M06-2X studies on tert-Butyl N-(thiophen-2yl)carbamate

Chemical Compounds

• Carbamate 64%
• Vibrational Frequency 61%
• Fourier Transform Infrared Spectroscopy 35%
• Correlation Function 20%
• Lowest Unoccupied Molecular Orbital 17%
• Highest Occupied Molecular Orbital 17%
• DFT-B3LYP Calculation 16%
• Calorific Value 16%
• Potential Energy 16%
• Chemical Method 14%
• Bond Length 13%
• Dihedral Angle 13%
• Density Functional Theory 9%
• Energy 7%
• Molecule 5%

Engineering & Materials Science

• Vibrational spectra 100%
• Discrete Fourier transforms 69%
• Molecular orbitals 53%
• Density functional theory 23%
• Bond length 23%
• Potential energy 17%
• Molecules 15%

Physics & Astronomy

• molecular orbitals 31%
• computer programs 23%
• solid phases 14%
• energy distribution 13%
• potential energy 13%
• density functional theory 12%
• energy 9%
• molecules 8%