F. Kandemirli, B. Köksoy, T. Arslan
Mar 17, 2009
Citations
0
Influential Citations
9
Citations
Journal
Journal of Molecular Structure
Abstract
Bis(fluoroisatinato)mercury(II) was synthesised from the reaction between 5-fluoroisatin (HFI) and mer- cury(II) acetate in methanol. Mercury(II) coordination with nitrogen atom of 5-fluoroisatin molecule was observed using the FT-IR and NMR spectra of the product. Quantum chemistry calculations for 5-fluoroi- satin (HFI) and bis(fluoroisatinato)mercury(II) (Hg(FI)2) were carried out. Vibrational analysis calculation at the RHF/LanL2DZ and B3LYP/LanL2DZ level was compared to the experimental solid-state data. UV- visible analyses were also studied.