Structural properties of liquid acetone

Citation
Yg. Bushuev et Sv. Dovletbaeva, Structural properties of liquid acetone, RUSS CHEM B, 48(1), 1999, pp. 25-34
Citations number
23
Categorie Soggetti
Chemistry
Journal title
RUSSIAN CHEMICAL BULLETIN
ISSN journal
10665285 → ACNP
Volume
48
Issue
1
Year of publication
1999
Pages
25 - 34
Database
ISI
SICI code
1066-5285(199901)48:1<25:SPOLA>2.0.ZU;2-P
Abstract
Monte Carlo simulation of liquid acetone was carried out. The effect of ele ctrostatic and van der Waals interactions on the regularities of mutual arr angement of the molecules was studied. Spatial structure of Liquid acetone is determined by the molecular shape, repulsive intermolecular interactions , and steric factors and is close to the structure of a random closely pack ed system of soft spheres. Electrostatic interactions affect only the mutua l orientation of the molecules.