Intermolecular structure and hydrogen-bonding in liquid 1,2-propylene carbonate and 1,2-glycerol carbonate determined by neutron scattering†
Yoan M. Delavoux,Mark Gilmore,Martin P. Atkins,Małgorzata Swadźba-Kwaśny,John D. Holbrey
Physical Chemistry Chemical Physics Pub Date : 12/15/2016 00:00:00 , DOI:10.1039/C6CP07790K
Abstract

Neutron diffraction with isotopic substitution has been used to investigate the liquid structures of propylene carbonate and glycerol carbonate. C–H⋯O[double bond, length as m-dash]C hydrogen-bonding motifs dominate the local structure of propylene carbonate, giving rise to the formation of head-to-tail correlated chains of molecules. In contrast, glycerol carbonate exhibits a more disordered structure with no overall dominant interactions in which the pendant hydroxyl function disrupts structure-making correlations present in propylene carbonate.

Graphical abstract: Intermolecular structure and hydrogen-bonding in liquid 1,2-propylene carbonate and 1,2-glycerol carbonate determined by neutron scattering