astatine has been researched along with hypoiodous-acid* in 1 studies
1 other study(ies) available for astatine and hypoiodous-acid
| Article | Year |
|---|---|
Competition of hydrogen bonds and halogen bonds in complexes of hypohalous acids with nitrogenated bases.
A theoretical study of the complexes formed by hypohalous acids (HOX, X = F, Cl, Br, I, and At) with three nitrogenated bases (NH 3, N 2, and NCH) has been carried out by means of ab initio methods, up to MP2/aug-cc-pVTZ computational method. In general, two minima complexes are found, one with an OH...N hydrogen bond and the other one with a X...N halogen bond. While the first one is more stable for the smallest halogen derivatives, the two complexes present similar stabilities for the iodine case and the halogen-bonded structure is the most stable one for the hypoastatous acid complexes. Topics: Astatine; Bromates; Computer Simulation; Fluorine Compounds; Halogenation; Hydrogen Bonding; Hypochlorous Acid; Iodine Compounds; Models, Chemical; Nitrogen Compounds; Quantum Theory | 2008 |