Verevkin, Sergey P. published the artcileEnergetics of LOHC: Structure-Property Relationships from Network of Thermochemical Experiments and in Silico Methods, Application of 2,3,5-Trimethylpyrazine, the main research area is liquid organic hydrogen carrier structure property relationship.
The storage of hydrogen is the key technol. for a sustainable future. We developed an in silico procedure, which is based on the combination of exptl. and quantum-chem. methods. This method was used to evaluate energetic parameters for hydrogenation/dehydrogenation reactions of various pyrazine derivatives as a seminal liquid organic hydrogen carriers (LOHC), that are involved in the hydrogen storage technologies. With this in silico tool, the tempo of the reliable search for suitable LOHC candidates will accelerate dramatically, leading to the design and development of efficient materials for various niche applications.
Hydrogen published new progress about Combustion enthalpy. 14667-55-1 belongs to class pyrazines, name is 2,3,5-Trimethylpyrazine, and the molecular formula is C7H10N2, Application of 2,3,5-Trimethylpyrazine.