𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Structure, Bonding, and Spectra of Cyclic Dithia Radical Cations: A Theoretical Study

✍ Scribed by Maity, Dilip K.


Book ID
127012277
Publisher
American Chemical Society
Year
2002
Tongue
English
Weight
234 KB
Volume
124
Category
Article
ISSN
0002-7863

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


Ab initio theoretical study of the elect
✍ A.B. Sannigrahi; P.K. Nandi; P.von R. Schleyer πŸ“‚ Article πŸ“… 1993 πŸ› Elsevier Science 🌐 English βš– 542 KB

The ground state electronic structures and dissociation energies ofthe dialkali halide cations MtM2X+ (M,, M, = Li, Na; X= F, Cl) have been calculated at the HF and post-HF (MPn) levels using a variety of basis sets. The calculated values are in good agreement with the corresponding experimental dat

Electronic spectra and a theoretical stu
✍ Cyril PΓ‘rkΓ‘nyi; Georgine M. Sanders; Marinus van Dijk; Prof. Dr. E. Havinga πŸ“‚ Article πŸ“… 2010 πŸ› Elsevier Science 🌐 English βš– 534 KB

## Abstract The PPP (__Pariser‐Parr‐Pople__) method has been used to study the quinolizinium ion (**1**) and the four isomeric bromoquinolizinium ions (**2–5**). The results have been used to interpret their electronic absorption and emission (fluorescence, phosphorescence) spectra. Also, predictio