𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Structure and nonlinear electrical properties of squaric acid derivatives: a theoretical study of the conformation and deprotonation effects

✍ Scribed by M. Spassova; T. Kolev; I. Kanev; D. Jacquemin; B. Champagne


Book ID
114144007
Publisher
Elsevier Science
Year
2000
Tongue
English
Weight
307 KB
Volume
528
Category
Article
ISSN
0166-1280

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


Theoretical studies on the conformation
✍ Tibor KoΕΎΓ‘r; Igor TvaroΕ‘ka πŸ“‚ Article πŸ“… 1990 πŸ› Wiley (John Wiley & Sons) 🌐 English βš– 586 KB

The 2-methylaminotetrahydropyran was used as a model to study conformational properties of the N-glycosidic linkage in glycosylamines. Relaxed two-dimensional conformational (%, 9 ) maps in 20 solvents were calculated by a method in which the total energy is divided into the energy of the isolated m

A theoretical study of the linear, nonli
✍ G. Uğurlu; E. Kasap; Z. Kantarci; M. Bahat πŸ“‚ Article πŸ“… 2007 πŸ› Elsevier Science 🌐 English βš– 250 KB

In this study, we have investigated the energies, dipole moments, HOMO-LUMO energy differences and polarizability values of 3phenylthiophene and its fluoro-substitued derivatives as a function of the torsional angle. For each molecule, geometrical parameters have obtained using ab initio [Hartree-Fo