𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Separability of local reactivity descriptors

✍ Scribed by Akhilesh Tanwar; Sourav Pal


Book ID
110644326
Publisher
Indian Academy of Sciences,Royal Society of Chemistry
Year
2005
Tongue
English
Weight
136 KB
Volume
117
Category
Article
ISSN
0253-4134

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


Reactivity and stability of aromatic car
✍ R. K. Roy; K. Choho; F. De Proft; P. Geerlings πŸ“‚ Article πŸ“… 1999 πŸ› John Wiley and Sons 🌐 English βš– 85 KB

The reactivity of acetaldehyde and some aromatic aldehydes towards acid-catalysed oxygen-18 exchange reactions with H 2 O 18 was studied using the density functional theory (DFT)-based reactivity descriptors local softness and local hardness. Local softness is used to predict the preferable reactive