Theoretical description of R–X· · · NH<inf>3</inf> halogen bond complexes: Effect of the R group on the complex stability and sigma-hole electron depletion

Article

Abstract: In the present work, a number of R–X· · · NH3 (X = Cl, Br, and I) halogen bonded systems were theore

Palabras claves:

Conditional pair density, Fermi-hole, Halogen bond, Kullback–Leibler divergence, Sigma-hole

Autores:

César H. Zambrano, Fernando Javier Torres, Jose R. Mora, Juan Zurita, Luis Rincon, Vladimir Rodríguez

Fuentes:

scopus