✦ LIBER ✦
The correlation of 11B NMR ASIS effects with MO-derived charge densities for closo-C2B5H7 and some chloro derivatives
✍ Scribed by Thomas Onak; Zahid J. Abdou; Gaby Abdou; Sergio Herrera
- Publisher
- John Wiley and Sons
- Year
- 1992
- Tongue
- English
- Weight
- 316 KB
- Volume
- 3
- Category
- Article
- ISSN
- 1042-7163
No coin nor oath required. For personal study only.
✦ Synopsis
derived hydrogen charges . Also, solvent effects on llB NMR shifts of some metallaboranes and metallacarboranes as well as on decaborane(l4) [91] have been previously noted. As cited below, we report ' 'B ASZS effects for c1oso-2,4-C2B5H7 and its 5-chloro and 5,6-dichloro derivatives, Figure . We have recently carried out ab initio STO-3G calculations on these three molecules, and it was of interest to see if the benzene induced I'B NMR shifts could be correlated to MO-derived atom charges.