Theoretical and Infrared Investigation of the Conformations of 1,3-Dihaloacetones
✍ Scribed by Tormena, Cláudio F.; Freitas, Matheus P.; Rittner, Roberto; Abraham, Raymond J.
- Book ID
- 126181005
- Publisher
- American Chemical Society
- Year
- 2004
- Tongue
- English
- Weight
- 150 KB
- Volume
- 108
- Category
- Article
- ISSN
- 1089-5639
No coin nor oath required. For personal study only.
📜 SIMILAR VOLUMES
## Abstract The complete analysis of the complex ^1^H NMR spectra of some monosubstituted cyclobutanes was achieved to give all the ^1^H chemical shifts and ^__n__^__J__~HH~ (__n__ = 2, 3 and 4) coupling constants in these molecules. The substituent chemical shifts of the substituents in the cyclob
## Abstract The conformations of __cis__‐ (**1**) and __trans__‐cyclopentane‐1,3‐diol (**2**) have been studied by __ab initio__ (Gaussian 98) and molecular mechanics (PCMODEL) calculations and by NMR spectroscopy. The calculations gave two low‐energy conformations for (**1**), **1A** and **1B**, b