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Article
Synthesis and Physicochemical Properties of Nanopowders and Ceramics in a CeO2–Gd2O3 System
Nanopowders with a composition of (СeO2)1–x(Gd2O3)x (x = 0.03, 0.05, 0.07, and 0.10) are synthesized by the coprecipitation method using cryotechnologies. The coherent scattering region (CSR) of the powders is 10...
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Article
Intentional selection of coordination compounds with the required thermochemical properties on the basis of the cambridge bank of structural data
A structural-thermochemical analysis of the Cambridge bank of structural data was performed according to specified number and types of intermolecular contacts. The TOPOS package and the SFERA and KONTAKT progr...
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Article
Molecular structure of C(SiCl3)4 tetrakis-(trichlorosilyl)methane
Methods of quantum chemistry and gas phase electron diffraction (at a temperature of 303±5 K) are applied to determine parameters of the geometric configuration of C(SiCl3)4 tetrakis(trichlorosilyl)methane. Frequ...
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Article
The thermodynamic properties and thermal decomposition of octachlorotrisilane Si3Cl8
The standard enthalpies of formation of liquid and gaseous octachlorotrisilane were estimated, Δf H o (298.15, Si3Cl8, g) = −1397(9) kJ/mol and Δf H ...
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Article
Molecular structure of octachlorotrisilane Si3Cl8
The parameters of the geometrical configuration of octachlorotrisilane Si3Cl8 were determined by quantum-chemical and gas-phase electron diffraction methods at 303±2 K. The calculated barrier to the internal rota...
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Article
The lead(II) complexes with 18-Crown-6, 1,1,1,5,5,5-hexafluoropentane-2,4-dionate and 1,1,1-trifluoropentate-2,4-dionate anions: Synthesis, structure, and thermochemical properties
The complexes trans-[Pb(18-crown-6)(NO3)2] (I), trans-[Pb(18-crown-6)(Hfa)2] (II), and [Pb2(18-crown-6)(Tfa)4] (III), where Hhfa is 1,1,1,5,5,5-hexafluoropentane-2,4-dione and Htfa is 1,1,1-trifluoropentane-2,4-d...
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Article
Coordination compounds with the general formula trans-[M(18-crown-6)(C5HO2F6)2] as structural-thermochemical analogs. The complexes trans-[Pb(18-crown-6)(C5HO2F6)2] and trans-[Ba(18-crown-6)(C5HO2F6)2]
The molecular geometries of the complexes trans-[M(18-crown-6)(C5HO2F6)2] (where M = Ca, Sr, Ba (I), Zn, Cd, Sn, Pb (II), Fe, Co, Eu, and Yb) were modeled by the molecular mechanics method with fixed R(M-O) dista...
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Article
Vaporization of Molecular Strontium and Barium β-Diketonates [Sr(15C5)(C5O2F6H)2] and [Ba(18C6)(C5O2F6H)2]. Structure-Thermochemical Approach
Vaporization of the barium molecular complex [Ba(18C6)(C5O2F6H)2] and the newly prepared strontium complex [Sr(15C5)(C5O2F6H)2] was studied using a semiempirical structure-thermochemical approach. The studies of ...