Ligational, density functional theory, and biological studies on some new Schiff base 2‐(2‐hydroxyphenylimine)benzoic acid (L) metal complexes

Walaa H. Elshwiniy; Asmaa G. Ibrahim; Sadeek A. Sadeek; Wael A. Zordok

doi:10.1002/aoc.5819

Ligational, density functional theory, and biological studies on some new Schiff base 2‐(2‐hydroxyphenylimine)benzoic acid (L) metal complexes

Applied Organometallic Chemistry ◽

10.1002/aoc.5819 ◽

2020 ◽

Vol 34 (10) ◽

Cited By ~ 1

Author(s):

Walaa H. Elshwiniy ◽

Asmaa G. Ibrahim ◽

Sadeek A. Sadeek ◽

Wael A. Zordok

Keyword(s):

Density Functional Theory ◽

Schiff Base ◽

Benzoic Acid ◽

Metal Complexes ◽

Density Functional ◽

Functional Theory ◽

Biological Studies

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Spectroscopic, density functional theory, nonlinear optical properties and in vitro biological studies of Co(II), Ni(II), and Cu(II) complexes of hydrazide Schiff base derivatives

Applied Organometallic Chemistry ◽

10.1002/aoc.6246 ◽

2021 ◽

Author(s):

Ramadan M. Ramadan ◽

Samir M. El‐Medani ◽

Abdelmoneim Makhlouf ◽

Hussein Moustafa ◽

Manal A. Afifi ◽

...

Keyword(s):

Density Functional Theory ◽

Optical Properties ◽

Schiff Base ◽

Density Functional ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

Functional Theory ◽

Schiff Base Derivatives ◽

Biological Studies

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A Joint Study on Juglone Metal Complexes by InfraredÂ Spectroscopy and Density Functional Theory Calculations

10.3390/ecsoc-17-e005 ◽

2013 ◽

Author(s):

Ines Mancini ◽

Andrea Defant ◽

Costantino Tomasi

Keyword(s):

Density Functional Theory ◽

Metal Complexes ◽

Density Functional ◽

Density Functional Theory Calculations ◽

Functional Theory ◽

Joint Study

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Calculation of the Zeeman Effect for Transition-Metal Complexes by Multiconfiguration Pair-Density Functional Theory

Journal of Chemical Theory and Computation ◽

10.1021/acs.jctc.1c00208 ◽

2021 ◽

Author(s):

Chen Zhou ◽

Dihua Wu ◽

Laura Gagliardi ◽

Donald G. Truhlar

Keyword(s):

Density Functional Theory ◽

Transition Metal ◽

Metal Complexes ◽

Transition Metal Complexes ◽

Density Functional ◽

Zeeman Effect ◽

Functional Theory ◽

Pair Density

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Ability of fullerenes to act as ?6 ligands in transition metal complexes. A comparative PM3(tm)-density functional theory study

Journal of Computational Chemistry ◽

10.1002/jcc.1138 ◽

2001 ◽

Vol 22 (16) ◽

pp. 1881-1886 ◽

Cited By ~ 7

Author(s):

Sor-Koon Goh ◽

Dennis S. Marynick

Keyword(s):

Density Functional Theory ◽

Transition Metal ◽

Metal Complexes ◽

Transition Metal Complexes ◽

Density Functional ◽

Density Functional Theory Study ◽

Functional Theory

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CO2 reduction catalysis by tunable square-planar transition-metal complexes: a theoretical investigation using nitrogen-substituted carbon nanotube models

Physical Chemistry Chemical Physics ◽

10.1039/c7cp06024f ◽

2017 ◽

Vol 19 (43) ◽

pp. 29068-29076 ◽

Cited By ~ 4

Author(s):

Yu-Te Chan ◽

Ming-Kang Tsai

Keyword(s):

Density Functional Theory ◽

Carbon Nanotube ◽

Transition Metal ◽

Metal Complexes ◽

Transition Metal Complexes ◽

Density Functional ◽

Co2 Reduction ◽

Functional Theory ◽

Square Planar ◽

Planar Transition

The CO2 reduction capabilities of transition-metal-chelated nitrogen-substituted carbon nanotube models (TM-4N2v-CNT, TM = Fe, Ru, Os, Co, Rh, Ir, Ni, Pt or Cu) are characterized by density functional theory.

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Density Functional Theory Studies on the Stability of Alkaline Metal Complexes of Pentazole and Oxopentazole Anions

Bulletin of the Korean Chemical Society ◽

10.1002/bkcs.11329 ◽

2017 ◽

Vol 38 (12) ◽

pp. 1474-1480

Author(s):

Insook Kang ◽

Soo Gyeong Cho ◽

Hai Whang Lee ◽

Kiyull Yang

Keyword(s):

Density Functional Theory ◽

Metal Complexes ◽

Density Functional ◽

Alkaline Metal ◽

Functional Theory ◽

The Stability

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Transformation of a ditopic Schiff base nickel(II) nitrate complex into an unsymmetrical Schiff base complex by partial hydrolytic degradation: structural and density functional theory studies

Transition Metal Chemistry ◽

10.1007/s11243-014-9840-y ◽

2014 ◽

Vol 39 (6) ◽

pp. 613-621 ◽

Cited By ~ 5

Author(s):

Qiang Wang ◽

Yang Liu ◽

Wei Gao ◽

Zhijun Xu ◽

Yuguang Li ◽

...

Keyword(s):

Density Functional Theory ◽

Schiff Base ◽

Density Functional ◽

Hydrolytic Degradation ◽

Schiff Base Complex ◽

Nitrate Complex ◽

Functional Theory ◽

Base Complex ◽

Unsymmetrical Schiff Base

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A New Synthesized Schiff Base as Corrosion Inhibitor for Mild Steel in a HCl Medium: Experimental, Density Functional Theory and Molecular Dynamics Simulation Studies

Portugaliae Electrochimica Acta ◽

10.4152/pea.2021390504 ◽

2021 ◽

Vol 39 (5) ◽

pp. 349-379

Author(s):

I Kaabi ◽

T Douadi ◽

D Daoud ◽

S Amamra ◽

S Chafaa

Keyword(s):

Molecular Dynamics ◽

Density Functional Theory ◽

Schiff Base ◽

Molecular Dynamics Simulation ◽

Density Functional ◽

Dynamics Simulation ◽

Simulation Studies ◽

Functional Theory ◽

Experimental Density ◽

Hcl Medium

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Time Dependent Density Functional Theory description of giant resonances in transition metal complexes: The photoionization dynamics of Cr(CO)6

Chemical Physics ◽

10.1016/j.chemphys.2009.05.006 ◽

2009 ◽

Vol 361 (1-2) ◽

pp. 49-60 ◽

Cited By ~ 5

Author(s):

M. Stener ◽

G. Fronzoni ◽

P. Decleva

Keyword(s):

Density Functional Theory ◽

Transition Metal ◽

Metal Complexes ◽

Transition Metal Complexes ◽

Density Functional ◽

Time Dependent ◽

Giant Resonances ◽

Functional Theory ◽

Dependent Density

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Synthesis, characterization, density functional theory, X-ray study, thermal stability, and biological and MOE relevance of metal complexes of griseofulvin

Applied Organometallic Chemistry ◽

10.1002/aoc.4312 ◽

2018 ◽

Vol 32 (5) ◽

pp. e4312 ◽

Cited By ~ 2

Author(s):

Walaa H. Mahmoud ◽

Nessma F. Mahmoud ◽

Gehad G. Mohamed

Keyword(s):

Thermal Stability ◽

Density Functional Theory ◽

Metal Complexes ◽

Density Functional ◽

Functional Theory ◽

X Ray ◽

Theory X

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