| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 1230377 | Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy | 2014 | 14 Pages |
Abstract
Geometry of (2S)-2-[(2-{[(2S)-1-hydroxybutan-2-y1]amino}ethyl)amino]butan-1-ol optimized at DFT/B3LYP/6-31G(d,p).
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Analytical Chemistry
![Vibrational assignment, HOMO-LUMO and NBO analysis of (2S)-2-[(2-{[(2S)-1-hydroxybutan-2-yl]amino}ethyl)amino]butan-1-ol by density functional theory](/preview/png/1230377.png "First Page Preview: Vibrational assignment, HOMO-LUMO and NBO analysis of (2S)-2-[(2-{[(2S)-1-hydroxybutan-2-yl]amino}ethyl)amino]butan-1-ol by density functional theory")
Authors
K. Rajalakshmi, S. Gunasekaran, S. Kumaresan,