Reaction of [(DIPePBDI)SrH]2 with C6H5X (X=Cl, Br, I) led to hydride-halogenide exchange (DIPePBDI=HC[(Me)CN-2,6-(3-pentyl)phenyl]2). Conversion rates increase increasing halogen size (F<Cl<Br<I). C6H5F was slow and ill-defined but addition C6H4F2 gave smooth hydride-fluoride exchange. After THF the full range Sr halogenides structurally characterized: [(DIPePBDI)SrX ? THF]2 (X=F, Cl, I). Mixtu...

in this study the binding abilities of 1,3-calix[4]biscrown-6 (l) toward ba2+ and ca2+ have beenestablished in methanol by spectrophotometric measurements at 25±0.1 °c and 0.01 m ionicstrength, and with using specfit computer program; stability constants for 2 : 1, metal : ligandcomplexes has been estimated

The structures of two derivatives of the bisdioxine diisocyanate 1, the bisurea 4 and the biscarbamate 5, are established by X-ray crystallography and DFT calculations. These compounds possess endo,endo structures, in the case of the bisurea 4 with two nearly parallel pendant chains. The X-ray structures are reproduced very well by DFT calculations. Similar endo,endo conformations are calculate...

In this work, we analyze the geometry and electronic structure of the [X(n)M(3)](n-2) species (M = Be, Mg, and Ca; X = Li, Na, and K; n = 0, 1, and 2), with special emphasis on the electron delocalization properties and aromaticity of the cyclo-[M(3)](2-) unit. The cyclo-[M(3)](2-) ring is held together through a three-center two-electron bond of sigma-character. Interestingly, the interaction ...