𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Study of the effect of substitution in the C4 cytosine by Density Functional Theory

✍ Scribed by Mozhgan Mahmoodi Aval; Mahbob Jamali; Jalal Shakhs Emampour; Homa Moghadam

Book ID
118431314
Publisher
Elsevier Science
Year
2011
Tongue
English
Weight
71 KB
Volume
44
Category
Article
ISSN
0009-9120

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

Effect of fluorine substitution on the p
Effect of fluorine substitution on the proton transfer barrier in malonaldehyde. A density functional theory study
✍ Fabio Pichierri πŸ“‚ Article πŸ“… 2003 πŸ› Elsevier Science 🌐 English βš– 264 KB

The effect of fluorine substitution on the proton transfer barrier (DE PT ) of malonaldehyde (1) has been investigated with the aid of density functional theory (DFT) calculations carried out at the B3LYP/cc-pVTZ level of theory. The results indicate that fluorine substitution in 1 increases the ene