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نمایش تعداد 1-10 از 33
A new equation of state for predicting the thermodynamic properties of liquid alkali metals
The d. of liq. alkali metals in the extended ranges of temp. and pressure was calcd. using a new equation of state (EoS) in view of nuclear reactor application. A wide comparison with exptl. data was made. The equation ...
Prediction of thermodynamic properties of polymeric liquids using a new equation of state
In this paper, we have used a simple equation of state (EoS) to predict the d. for polymeric liq. mixts. at different temps., pressures, and compns. The excess molar volumes of these mixts. have been also calcd. using ...
Conformation, molecular structure, and vibrational assignment of bis(3,5-heptanedionato)copper(II)
Density functional theory (DFT) and Atoms-in-Molecules (AIM) analyses as well as Fourier transform
Infrared, Raman, and UV spectra have been used to investigate the structure and vibrational spectra of
bis(3,5-hept ...
Conformations, molecular structure, and N–H⋯O hydrogen bond strength in 4-Alkylamino-3-penten-2-ones
4-Alkylamino-3-penten-2-ones (R-APO), R = H, CH3, C2H5, CH(CH3)2, and C(CH3)3, were synthesized by amination of acetylacetone and the products were characterized by 1HNMR spectroscopy. The intramolecular hydrogen bonding ...
Conformational analysis and intramolecular hydrogen bond strength of methyl 3-aminocrotonate
β-Enaminones have been widely studied because they can be found in biological systems such as
proteins [1]. Additionally, they are applied as psychoactive drugs [2]. These compounds,
theoretically, are capable ...
Structure of bis(3-amino-1-phenyl-2-buten-1-onato) copper(II) and prediction of its formation constant
Introduction
-Enaminones are versatile synthetic intermediates and have been extensively used for the preparation of a variety of heterocyclic systems [1,2]. Therefore, their transition metal complexes can act ...