𝔖 Bobbio Scriptorium
✦   LIBER   ✦

ab initiocalculations of the geometrical and electronic structure of thiophene and 2-chlorothiophene molecules

✍ Scribed by V. P. Feshin; E. V. Feshina


Publisher
Springer US
Year
1999
Tongue
English
Weight
249 KB
Volume
35
Category
Article
ISSN
0009-3122

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


Electronic and geometrical structure of
✍ Fabien Gatti; Nathalie Berthe-Gaujac; Isabelle Demachy; FranΓ§ois Volatron πŸ“‚ Article πŸ“… 1995 πŸ› Elsevier Science 🌐 English βš– 421 KB

The structure of the diboroxane H2B-O-BH2 has been studied by means of ab initio calculations at the MP4/6-311G\*\*// MP2/6-31 IG\*\* level. Two minima have been characterized on the potential energy surface (PES): one is of DEd symmetry, analogous to the isoelectronic allene molecule, and the other