## Abstract The ^1^H and ^13^C NMR chemical shifts of __spiro__βcycloalkylidene[60]fullerenes were assigned using experimental NMR data and the Density Functional Theory (DFT)βGauge Independence Of Atomic Orbitals method (GAIO) calculation method in the Perdew Burke Ernzerhof (PBE)/3z approach. The
β¦ LIBER β¦
Steric contributions to carbon-13 chemical shifts of 1- and 2-methyl adamantanes by DFT/GIAO
β Scribed by P.R Seidl; K.Z Leal
- Book ID
- 114141360
- Publisher
- Elsevier Science
- Year
- 2001
- Tongue
- English
- Weight
- 83 KB
- Volume
- 539
- Category
- Article
- ISSN
- 0166-1280
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