On the significant importance of Hg··· Cl spodium bonding/σ/π-hole/noncovalent interactions and nanoelectronic/conductivity applications in mercury complexes …

S Hazra, D Majumdar, A Frontera, S Roy… - Crystal Growth & …, 2024 - ACS Publications
This work synthesized two Hg complexes (1–2) using a LO-rich ligand (LO-rich= LO-
VAN/LET-VAN) in CH3OH and CH3OH/DCM media. Complex 1 is discrete [(HgCl2) 3LO …

Synthesis, spectroscopic investigation, molecular docking, ADME/T toxicity predictions, and DFT study of two trendy ortho vanillin-based scaffolds

D Majumdar, A Dubey, A Tufail, D Sutradhar, S Roy - Heliyon, 2023 - cell.com
In this article, we have synthesized two contemporary ortho-vanillin-based Salen-type
ligands (H 2 L 1/H 2 L 2) characterized by modern spectroscopic tools. EDX analysis …

l-Isoleucine-Schiff Base Copper(II) Coordination Polymers: Crystal Structure, Spectroscopic, Hirshfeld Surface, and DFT Analyses

IF Chavez-Urias, LE López-González… - ACS …, 2023 - ACS Publications
A new copper (II) coordination polymer was synthesized from the l-isoleucine-Schiff base
and characterized by elemental analysis, Fourier transform infrared (FT-IR) spectroscopy …

Crystal engineering of Pb (II)-salen coordination polymer enforced for the selective fluorescence NACs sensing activity in a dispersed aqueous medium: A combined …

D Majumdar, S Roy, A Frontera, RM Gomila… - Journal of Molecular …, 2023 - Elsevier
A new 1D coordination polymer (CP),[(SCN) Cd (L 1) Pb (NCS)] n (1) was synthesized using
N 2 O 4-based Scaffold (H 2 L 1= N, N'-bis (3-methoxysalicylidenimino)-1, 3 …

A new trinuclear Cd (II)-based coordination polymer with Salen ligand building blocks: Synthesis, crystallographic aspects, and optimistic photosensitive Schottky …

D Majumdar, S Roy, A Dey, D Sutradhar - Journal of Molecular Structure, 2023 - Elsevier
A new X-ray-characterized Cd (II)-based coordination polymer has been synthesized using
Salen ligand (H 2 L 1) and dicyanamide ion (dca)[N (CN) 2]−, and characterized using …

Experimental and Theoretical Survey of Intramolecular Spodium Bonds/σ/π-Holes and Noncovalent Interactions in Trinuclear Zn(II)-Salen Type Complex with OCN …

D Majumdar, A Frontera, S Roy, D Sutradhar - ACS omega, 2023 - ACS Publications
In this work, one new centrosymmetric trinuclear Zn (II) complex 1,[{(OCN) Zn (L)} 2Zn], using
a salen-type ligand (H2L) in the presence of OCN–was synthesized and characterized via …

Transition between the Noncovalency and Covalency of σ–Hole Bonds

S Scheiner - The Journal of Physical Chemistry A, 2023 - ACS Publications
The properties of the bond between a N-ligand and a Lewis acid containing a σ–hole are
studied by quantum chemical methods. Interactions considered include pnicogen bonds …

Synthesis and computational investigation of N, N-dimethyl-4-[(Z)-(phenylimino) methyl] aniline derivatives: Biological and quantitative structural activity relationship …

I Waziri, MT Kelani, MO Oyedeji-Amusa… - Journal of Molecular …, 2023 - Elsevier
This study describes the synthesis, characterisation and biological activities of four Schiff
base compounds, namely: N, N-dimethyl-4-(((4-nitrophenyl) imino) methyl) aniline (ABS1), 4 …

On the pivotal role of tetrel bonding in the supramolecular architectures of Pb II–NCS complexes with chelating thiosemicarbazide derivatives

B Eftekhari-Sis, I García-Santos, A Castiñeiras… - …, 2024 - pubs.rsc.org
Three new PbII complexes [Pb (LI)(SCN)] n,{[Pb (LII)](SCN)} n and {[Pb (HLIII)(SCN)](SCN)}
n (HLI= N′-phenyl (pyridin-2-yl) methylene-N-phenylthiosemicarbazide, HLII= N′-amino …

The importance of spodium bonds, H-bonds and π-stacking interactions in the solid state structures of four zinc complexes with tetradentate secondary diamine …

P Middya, M Karmakar, RM Gomila… - New Journal of …, 2023 - pubs.rsc.org
In this manuscript we report the preparation of four new zinc complexes,[{(μ-CH3COO)
ZnL1} 2Zn]· 2DMSO (1),[{(DMF) ZnL1 (μ-CH3COO) ZnL1Zn (N3)}]· 0.64 DMSO· 0.36 EtOH …