Open Access 
Downloads
Download data is not yet available.
Abstract
In the paper, the influence of solvents on the vibrational spectrum of acrolein will be investigated using ab initio calculations by program Gaussian 98 at 6-31+G(d) level with model Onsager SCRF = Dipole. It was found that these results of the calculation can explain parently the shifts of bands due to the polarizability especially for v(C=0), v(C=C) stretching ones. The FT-Raman spectrum of acrolein has also been recorded for comparison.
Author's Affiliation
Article Details
Issue: Vol 3 No 1 (2000)
Page No.: 34-43
Published: Jan 31, 2000
Section: Article
DOI: https://doi.org/10.32508/stdj.v3i1.3524
Copyright Info
Copyright: The Authors. This is an open access article distributed under the terms of the Creative Commons Attribution License CC-BY 4.0., which permits unrestricted use, distribution, and reproduction in any medium, provided the original author and source are credited.
How to Cite
Thanh Dat, H., Ai Phuong, D., & Van Den, N. (2000). STUDYING THE INLUENCE OF SOLVENTS ON THE VIBRATIONAL PECTRUM OF ACROLEIN BY AB INITIO CALCULATIONS. Science and Technology Development Journal, 3(1), 34-43. https://doi.org/https://doi.org/10.32508/stdj.v3i1.3524
Download Citation
Cited by
Article Statistics
HTML = 992 times
Download PDF = 345 times
Total = 345 times
Download PDF = 345 times
Total = 345 times
