𝔖 Bobbio Scriptorium
✦   LIBER   ✦

A quantum chemical investigation of CO, NF, SO, CF2 and their combination products

✍ Scribed by Peter Mathies; Friedrich O. Sladky; Bernd M. Rode


Publisher
Elsevier Science
Year
1982
Tongue
English
Weight
424 KB
Volume
90
Category
Article
ISSN
0022-2860

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


(Οƒ3,Ξ»5)-phosphoranes versus (Οƒ3,Ξ»3)-thia
✍ K. V. Turcheniuk; A. B. Rozhenko πŸ“‚ Article πŸ“… 2012 πŸ› John Wiley and Sons 🌐 English βš– 868 KB

## Abstract By sulfurization of phosphaalkenes (**a**) either (Οƒ^3^,Ξ»^5^)‐phosphoranes (**b**) or (Οƒ^3^,Ξ»^3^)‐thiaphosphiranes (**c**) are formed. In this study, Density Functional Theory (DFT) and coupled cluster (CCSD(T)) calculations have been carried out for model and experimental structures of

[HRh(CO)4]-Catalyzed Hydrogenation of Co
✍ Ulrich Pidun; Gernot Frenking πŸ“‚ Article πŸ“… 1998 πŸ› John Wiley and Sons 🌐 English βš– 468 KB πŸ‘ 1 views

The mechanism of the [HRh(CO) 4 ]-catalyzed hydrogenation of carbon monoxide has been studied with the help of ab initio quantumchemical calculations at the MP2 level of theory. A quasirelativistic effective core potential was used at rhodium in combination with valence basis sets of double-zeta qua