Incisive structure-spectroscopic correlation in oligothiophenes functionalized with (±) inductive/mesomeric fluorine groups: Joint Raman and DFT study

Keyphrases

• Electronic Structure 100%
• Electronic Properties 100%
• Density Functional Theory 100%
• Oligothiophene 100%
• Core Length 100%
• Fluorine Groups 100%
• Aromatics 50%
• Conjugation 50%
• Inductive Effect 50%
• Chain Length 50%
• Vibrational Properties 50%
• Regiochemistry 50%
• Thienyl 50%
• Electron Delocalization 50%
• Bond Length Alternation 50%
• Terminal Position 50%
• Conjugation Length 50%
• Perfluoroarenes 50%
• Cyano Group 50%
• B3LYP/6-31G 50%
• Whole Systems 50%
• Conformational Distortion 50%
• Raman Wavenumbers 50%
• External Ring 50%
• Collective Character 50%

Chemistry

• Electronic State 100%
• Density Functional Theory Study 100%
• Fluorine 100%
• Wavenumber 50%
• Bond Length 50%
• Electronic Property 50%
• Regiochemistry 50%
• DFT-B3LYP Calculation 50%
• Cyano Group 50%
• Electron Delocalization 50%
• Inductive Effect 50%
• electronics 50%
• Oligomer 50%

Material Science

• Density 100%
• Energy Levels 100%
• Electronic Property 50%
• Oxidation Reaction 50%