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- Jan 30, 2018
H-Mediated Magnetic Interactions between Layers in a 2D MnII-Dicyanamide Polymer: Neutron Diffraction, DFT, and Quantum Monte Carlo Calculations
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- Jan 30, 2018
Mechanistic Studies on NaHCO3 Hydrogenation and HCOOH Dehydrogenation Reactions Catalysed by a FeIILinear Tetraphosphine Complex
Marcos, et al. Chem. Eur. J., 2018, online, doi:10.1002/chem.201704927- Publication
- Jan 30, 2018
Strategies for the Molecular Design of Donor-Acceptor-type Fluorescent Emitters for Efficient Deep Blue Organic Light Emitting Diodes
Woo, et al. Chem. Mater., 2018, In Press, DOI: 10.1021/acs.chemmater.7b04437- Publication
- Jan 30, 2018
Synthesis and characterization of phosphorescent isomeric iridium complexes with a rigid cyclometalating ligand
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- Jan 30, 2018
A complete computational and spectroscopic study of 2-bromo-1, 4-dichlorobenzene – A frequently used benzene derivative
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- Jan 30, 2018
Complexes of Zn(II) and Cd(II) with 2-acetylpyridine -aminoguanidine – Syntheses, structures and DFT calculations
Radanovi’, et al. Inorganica Chimica Acta., 2018, In Press, doi: 10.1016/j.ica.2017.12.038.- Publication
- Jan 30, 2018
Understanding reactivity of two newly synthetized imidazole derivatives by spectroscopic characterization and computational study
Hossain, et al. J. Molec. Struct., 2018, In Press, doi.org/10.1016/j.molstruc.2018.01.029- Publication
- Jan 30, 2018
Synthesis, spectroscopic analyses (FT-IR and NMR), vibrational study, chemical reactivity and molecular docking study and anti-tubercular activity of condensed oxadiazole and pyrazine derivatives
El-Azab, et al. J. Molec. Struct., 2017, 1155, 184-195- Publication
- Jan 30, 2018
Combined spectroscopic, DFT, TD-DFT and MD study of newly synthesized thiourea derivative
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- Jan 30, 2018
Synthesis, characterization and computational study of the newly synthesized sulfonamide molecule
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- Jan 30, 2018
Photocatalytic degradation of 4-amino-6-chlorobenzene-1,3-disulfonamide stable hydrolysis product of hydrochlorothiazide: Detection of intermediates and their toxicity
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- Jan 30, 2018
Adsorption properties of graphene towards the ephedrine – A frequently used molecule in sport
Armakovi’, et al. Comput. Theor. Chem., 2018, 1124 (15), 39-50Latest insights from Extrapolations blog
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