## Abstract Theoretical energy‐based conformational analysis of divinyl selenide performed at the MP2/6‐311G\*\* level is substantiated by the second‐order polarization propagator approach (SOPPA) calculations and experimental measurements of its ^77^Se^1^H spin–spin coupling constants, demonstrat
✦ LIBER ✦
Open-chain unsaturated selanyl sulfides: stereochemical structure and stereochemical behavior of their 77Se–1H spin–spin coupling constants
✍ Scribed by Yury Yu. Rusakov; Leonid B. Krivdin; Maxim V. Penzik; Vladimir A. Potapov; Svetlana V. Amosova
- Book ID
- 115560288
- Publisher
- John Wiley and Sons
- Year
- 2012
- Tongue
- English
- Weight
- 307 KB
- Volume
- 50
- Category
- Article
- ISSN
- 0749-1581
- DOI
- 10.1002/mrc.3858
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## Abstract Experimental measurements and second‐order polarization propagator approach (SOPPA) calculations of ^77^Se^1^H spin–spin coupling constants together with theoretical energy‐based conformational analysis in the series of 2‐substituted selenophenes have been carried out. A new basis set