The photochemistry of the chelated enol form of acetylacetone (AcAc) was investigated by UV excitation of the S(2) state at 266 nm in parahydrogen matrices, complemented by experiments in neon and normal hydrogen matrices. Infrared (IR) spectroscopy, combined with theoretical calculations, was used to identify the photoproducts. Isomerization towards various non-chelated forms (no intramolecula...

Time-dependent density functional theory (TDDFT) has been applied to study core excitations from 1s and 2p Mn orbitals in a series of manganese complexes with oxygen and nitrogen donor ligands. The effect of basis set and functional on the excitation energy was evaluated in detail for one complex, Mn(acac)2 x (H2O)2. The results obtained for a range of compounds, namely, [Mn(Im)6]Cl2, Mn(CH3COO...

The orientation of the emissive dipole moment of seven iridium-based phosphorescent emitter molecules commonly used in organic light-emitting diodes (OLEDs) is investigated. The orientation of Ir(ppy)3, Ir(ppy)2(acac), Ir(chpy)3, Ir(dhfpy)2(acac), Ir(BT)2(acac), Ir(MDQ)2(acac), and Ir(piq)3 is determined by measuring the angle dependent spectral radiant intensity of the transverse magnetic pola...

A novel dinuclear platinum complex of (dfppy-mhb-dfppy)Pt(2)(acac)(2) was synthesized and characterized, where dfppy-mhb-dfppy is a binary C^N cyclometalated ligand containing two bridged 2,4-difluorophenylpyridine (dfppy) units and acac is 2,4-pentanedione anion. Compared to previously reported dinuclear platinum complexes with a binary ancillary ligand, this dinuclear platinum complex showed ...

By comparing the phosphorescence spectra of Gd(acac)3 (acac~acetylacetone), Gd(TFacac)3 (TFacac~ 1,1,1-trifluoroacetylacetone), the effects of fluorine replacement of hydrogen on the triplet state energy of the ligands were revealed. Fluorine can lower the triplet state energy of Hacac and make it more suitable for energy transfer towards the D4 state of terbium. Organic electroluminescent devi...

We report the structural characterization of vanadyl acetylacetonate in imidazolium room temperature ionic liquids--bbimNTf(2), bmimNTf(2), C(3)OmimNTf(2), bm(2)imNTf(2), bmimPF(6), bmimOTf, bmimBF(4), bmimMeCO(2), bmimMeSO(4), bmimMe(2)PO(4) and bmimN(CN)(2)--and organic solvents. The complex was characterized by visible electronic (Vis) and EPR spectroscopies. VO(acac)(2) shows solvatochromis...

A new sol±gel route was applied to prepare alumina ®lms by using AlCl3 ́6H2O as starting material and acetylacetone (AcAc) as additive. Our research results show that AcAc and aluminum form a complex compound in the sol, which makes the sol very stable. Meanwhile, the complex structure prevents the decomposition going on quickly during the sintering process and the obtained ®lms are free of crac...

A new derivative of zirconium (IV), [(acac)2Zr{ONC(Me)th-2}2] have been produced by treating bis(acetylacetonato)diisopropoxy zirconium(IV) with internally functionalised oxime HONC(Me)th-2 (where th = thiophene) in 1:2 stoichiometry, while refluxing in anhydrous toluene. After drying and purification, the product appeared as offwhite crystalline solid. Physico-chemical analysis of this derivat...

The asymmetric unit of the title compound, [U(C(5)H(7)O(2))(2)O(2)(H(2)O)]·C(4)H(4)N(2), contains one [UO(2)(acac)(2)(H(2)O)] (where acac is acetyl-acetonate) and two half-mol-ecules of pyrazine. It exhibits a UO(7) penta-gonal-bipyramidal coordination geometry about the U(VI) atom, involving two bidentate acetyl-acetonate ions and one water mol-ecule. The N atoms of the pyrazine mol-ecules are...

The title compound, C(11)H(18)N(2)S(4), was unexpectedly obtained during studies on the reactivity of the complex tris-(acac-κ(2)O,O')gallium(III) (acac is acetyl-acetonate) with C(4)H(8)NCS(2)H in dichloro-methane. The title compound shows disordered two pyrrolidine rings with major and minor occupancies of 0.546 (4) and 0.454 (4). Two (pyrrolidin-1-yl)carbothio-ylsulfanyl units are linked tog...