News Articles Tagged: DFT Analysis

The Spectroscopic Fingerprint of 9-Fluorenemethanol: Unlocking Structure and Dynamics

Explore the advanced spectroscopic techniques used to characterize 9-Fluorenemethanol. Understand how IR-UV spectroscopy and computational methods reveal its conformational dynamics and hydrogen-bonding interactions.

Corrosion Control in Acidic Environments: The Efficacy of Cinnamaldehyde Thiosemicarbazone

Discover how Cinnamaldehyde Thiosemicarbazone provides robust corrosion control for mild steel in acidic solutions, backed by advanced electrochemical and theoretical analyses.

The Role of Advanced Analytical Techniques in Pharmaceutical Intermediate Characterization

Discover how methods like X-ray diffraction and computational chemistry are essential for the thorough characterization of pharmaceutical intermediates.

Exploring the Chemical Properties of Theacrine: A Computational Analysis

Delve into the computational chemistry of Theacrine, comparing its electronic properties and reactivity to caffeine. Understand the science behind its potential as a stimulant alternative.