INVESTIGADORES
ARENA Mario Eduardo
artículos
Título:
Synthesis, characterization and crystal structure of 2-chloroethyl (methylsulfonyl) methanesulfonate
Autor/es:
BEN ALTABEF, AIDA; GALVAN, JORGE E; DEFONSI LESTARD, MARIA ELIANA; PIRO, OSCAR E.; ECHEVERRIA, GUSTAVO; ARENA, M. E.; MOLINA, ROCIO; ULIC, SONIA E.; TUTTOLOMONDO, MARIA EUGENIA
Revista:
NEW JOURNAL OF CHEMISTRY
Editorial:
ROYAL SOC CHEMISTRY
Referencias:
Lugar: CAMBRIDGE; Año: 2018
ISSN:
1144-0546
Resumen:
The aim of this work is to evaluate the structural, vibrational properties and the biologicalactivity of 2-Chloroethyl (methylsulfonyl) methanesulfonate, CH3SO2CH2SO2OCH2CH2Cl(Clomesone). The solid state molecular structure has been isolated and characterized by experimental (X-ray diffraction) and theoretical (DFT method) methodologies. The molecules are packed through C?H···O bifurcated interactions and Cl···Cl interactions.The experimental investigations were supplemented by quantum chemical calculation and Hirshfeld surface calculations. Furthermore, the infrared and Raman spectra for the solid phase have been recorded and the observed bands assigned to the vibrational normal modes. The study was completed by The Atoms-in-Molecules (AIM) theory and natural bond orbital (NBO) analysis. Finally, we study the function of Clomesone on biofilm formation and the study on a methansulfonate complex with respect to QS activity.
