Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

Coordination-Driven Poly[2]Pseudorotaxanes in Highly Polar Organic Solvent.

ABSTRACT: Self-assembly of polypseudorotaxanes in high-polar organic solvents is difficult due to remarkably weak interactions between macrocycles and axles. Reported here is a novel metal-coordinated poly[2]pseudorotaxane constructed by pillar[5]arene, 1,4-bis(4-pyridyl pyridinium)butane, and [PdCl₂(PhCN)₂] in highly polar organic solvent of dimethyl sulfoxide (DMSO). Utilizing a combination of ¹H NMR, NOESY, DOSY, DLS, SEM, and viscosity measurements, the formation of polypseudorotaxane was shown to be dependent on the concentration of [2]pseudorotaxanes/[PdCl₂(PhCN)₂] and temperature. Furthermore, a temperature-responsive supramolecular gel with reversibly gel-sol transformation was obtained via spontaneous assembly of the polypseudorotaxanes at high concentrations.

SUBMITTER: Su H

PROVIDER: S-EPMC7406859 | biostudies-literature | 2020

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

Coordination-Driven Poly[2]Pseudorotaxanes in Highly Polar Organic Solvent.

Su Hang H Chen Wei W Li Liang L Li Bin B Zhang Zhi-Yuan ZY Li Chunju C

Frontiers in chemistry 20200730

Self-assembly of polypseudorotaxanes in high-polar organic solvents is difficult due to remarkably weak interactions between macrocycles and axles. Reported here is a novel metal-coordinated poly[2]pseudorotaxane constructed by pillar[5]arene, 1,4-bis(4-pyridyl pyridinium)butane, and [PdCl2(PhCN)2] in highly polar organic solvent of dimethyl sulfoxide (DMSO). Utilizing a combination of 1H NMR, NOESY, DOSY, DLS, SEM, and viscosity measurements, the formation of po ...[more]

PMID: 32850622

Similar Datasets

Elucidating the Aromatic Properties of Covalent Organic Frameworks Surface for Enhanced Polar Solvent Adsorption.

Project description:Covalent organic frameworks (COFs) have a distinguished surface as they are mostly made by boron, carbon, nitrogen and oxygen. Many applications of COFs rely on polarity, size, charge, stability and hydrophobicity/hydrophilicity of their surface. In this study, two frequently used COFs sheets, COF-1 and covalent triazine-based frameworks (CTF-1), are studied. In addition, a theoretical porous graphene (TPG) was included for comparison purposes. The three solid sheets were investigated for aromaticity and stability using quantum mechanics calculations and their ability for water and ethanol adsorption using molecular dynamics simulations. COF-1 demonstrated the poorest aromatic character due to the highest energy delocalization interaction between B-O bonding orbital of sigma type and unfilled valence-shell nonbonding of boron. CTF-1 was identified as the least kinetically stable and the most chemically reactive. Both COF-1 and CTF-1 showed good surface properties for selective adsorption of water via hydrogen bonding and electrostatic interactions. Among the three sheets, TPG's surface was mostly affected by aromatic currents and localized π electrons on the phenyl rings which in turn made it the best platform for selective adsorption of ethanol via van der Waals interactions. These results can serve as guidelines for future studies on solvent adsorption for COFs materials.

| S-EPMC8199954 | biostudies-literature

A Stable High-Performance Zn-Ion Batteries Enabled by Highly Compatible Polar Co-Solvent.

Project description:Uncontrollable growth of Zn dendrites, irreversible dissolution of cathode material and solidification of aqueous electrolyte at low temperatures severely restrict the development of aqueous Zn-ion batteries. In this work, 2,2,2-trifluoroethanol (TFEA) with a volume fraction of 50% as a highly compatible polar-solvent is introduced to 1.3 M Zn(CF3SO3)2 aqueous electrolyte, achieving stable high-performance Zn-ion batteries. Massive theoretical calculations and characterization analysis demonstrate that TFEA weakens the tip effect of Zn anode and restrains the growth of Zn dendrites due to electrostatic adsorption and coordinate with H2O to disrupt the hydrogen bonding network in water. Furthermore, TFEA increases the wettability of the cathode and alleviates the dissolution of V2O5, thus improving the capacity of the full battery. Based on those positive effects of TFEA on Zn anode, V2O5 cathode, and aqueous electrolyte, the Zn//Zn symmetric cell delivers a long cycle-life of 782 h at 5 mA cm-2 and 2 mA h cm-2. The full battery still declares an initial capacity of 116.78 mA h g-1, and persists 87.73% capacity in 2000 cycles at -25 °C. This work presents an effective strategy for fully compatible co-solvent to promote the stability of Zn anode, V2O5 cathode and aqueous electrolyte for high-performance Zn-ion batteries.

| S-EPMC11425257 | biostudies-literature

Molecularly-porous ultrathin membranes for highly selective organic solvent nanofiltration.

Project description:Engineering membranes for molecular separation in organic solvents is still a big challenge. When the selectivity increases, the permeability tends to drastically decrease, increasing the energy demands for the separation process. Ideally, organic solvent nanofiltration membranes should be thin to enhance the permeant transport, have a well-tailored nanoporosity and high stability in harsh solvents. Here, we introduce a trianglamine macrocycle as a molecular building block for cross-linked membranes, prepared by facile interfacial polymerization, for high-performance selective separations. The membranes were prepared via a two-in-one strategy, enabled by the amine macrocycle, by simultaneously reducing the thickness of the thin-film layers (<10 nm) and introducing permanent intrinsic porosity within the membrane (6.3 Å). This translates into a superior separation performance for nanofiltration operation, both in polar and apolar solvents. The hyper-cross-linked network significantly improved the stability in various organic solvents, while the amine host macrocycle provided specific size and charge molecular recognition for selective guest molecules separation. By employing easily customized molecular hosts in ultrathin membranes, we can significantly tailor the selectivity on-demand without compromising the overall permeability of the system.

| S-EPMC7674481 | biostudies-literature

Highly mesoporous metal-organic framework assembled in a switchable solvent.

Project description:The mesoporous metal-organic frameworks are a family of materials that have pore sizes ranging from 2 to 50 nm, which have shown promising applications in catalysis, adsorption, chemical sensing and so on. The preparation of mesoporous metal-organic frameworks usually needs the supramolecular or cooperative template strategy. Here we report the template-free assembly of mesoporous metal-organic frameworks by using CO2-expanded liquids as switchable solvents. The mesocellular metal-organic frameworks with large mesopores (13-23 nm) are formed, and their porosity properties can be easily adjusted by controlling CO2 pressure. Moreover, the use of CO2 can accelerate the reaction for metal-organic framework formation from metal salt and organic linker due to the viscosity-lowering effect of CO2, and the product can be recovered through CO2 extraction. The as-synthesized mesocellular metal-organic frameworks are highly active in catalysing the aerobic oxidation of benzylic alcohols under mild temperature at atmospheric pressure.

| S-EPMC4109014 | biostudies-literature

Two-Dimensional Ketone-Driven Metal-Organic Coordination on Cu(111).

Project description:Two-dimensional metal-organic nanostructures based on the binding of ketone groups and metal atoms were fabricated by depositing pyrene-4,5,9,10-tetraone (PTO) molecules on a Cu(111) surface. The strongly electronegative ketone moieties bind to either copper adatoms from the substrate or codeposited iron atoms. In the former case, scanning tunnelling microscopy images reveal the development of an extended metal-organic supramolecular structure. Each copper adatom coordinates to two ketone ligands of two neighbouring PTO molecules, forming chains that are linked together into large islands through secondary van der Waals interactions. Deposition of iron atoms leads to a transformation of this assembly resulting from the substitution of the metal centres. Density functional theory calculations reveal that the driving force for the metal substitution is primarily determined by the strength of the ketone-metal bond, which is higher for Fe than for Cu. This second class of nanostructures displays a structural dependence on the rate of iron deposition.

| S-EPMC5074249 | biostudies-literature

Highly porous nanofiber-supported monolayer graphene membranes for ultrafast organic solvent nanofiltration.

Project description:Scalable fabrication of monolayer graphene membrane on porous supports is key to realizing practical applications of atomically thin membranes, but it is technologically challenging. Here, we demonstrate a facile and versatile electrospinning approach to realize nanoporous graphene membranes on different polymeric supports with high porosity for efficient diffusion- and pressure-driven separations. The conductive graphene works as an excellent receptor for deposition of highly porous nanofibers during electrospinning, thereby enabling direct attachment of graphene to the support. A universal “binder” additive is shown to enhance adhesion between the graphene layer and polymeric supports, resulting in high graphene coverage on nanofibers made from different polymers. After defect sealing and oxygen plasma treatment, the resulting nanoporous membranes demonstrate record-high performances in dialysis and organic solvent nanofiltration, with a pure ethanol permeance of 156.8 liters m−2 hour−1 bar−1 and 94.5% rejection to Rose Bengal (1011 g mol−1) that surpasses the permeability-selectivity trade-off.

| S-EPMC8442935 | biostudies-literature

Two-Dimensional Electronic Spectroscopy Reveals Dynamics and Mechanisms of Solvent-Driven Inertial Relaxation in Polar BODIPY Dyes.

Project description:In this work, we demonstrate the use of two-dimensional electronic spectroscopy (2DES) to study the mechanism and time scale of the femtosecond Stokes shift dynamics in molecules characterized by intramolecular charge transfer, such as distyryl-functionalized boron dipyrromethene (BODIPY) molecules. The obtained results demonstrate that 2DES allows clear and direct visualization of the phenomenon. The analysis of the 2D data in terms of 2D frequency-frequency decay associated maps provides indeed not only the time scale of the relaxation process but also the starting and the final point of the energy flow and the associated reorganization energy, identified by looking at the coordinates of a negative signature below the diagonal. The sensitivity of the 2DES technique to vibrational coherence dynamics also allowed the identification of a possible relaxation mechanism involving specific interaction between a vibrational mode of the dye and the solvent.

| S-EPMC5836106 | biostudies-literature

Mechanism simulation of polar and nonpolar organic solvent vapor adsorption on a multiwall carbon nanotubes paper gas sensor.

Project description:We investigate the adsorption behavior of polar and nonpolar molecules on carbon nanotube interfaces through computational simulations. Gaussian 16 was utilized to calculate the total energy of each possible molecular structure and analyze the adsorption mechanisms in stacked and inline configurations. The study reveals that nonpolar molecules favor stacked adsorption on two graphene interfaces, while polar molecules prefer inline adsorption. The findings suggest that inline adsorption of polar molecules results in minimal changes to the local dielectric constant, which may explain the absence of multi-step adsorption isotherms. The research examines the stability and energetics of molecular adsorption on graphene layers simulating CNT interfaces. Different types of molecules (polar and nonpolar) exhibit distinct adsorption behaviors, with nonpolar molecules aligning with the IUPAC type VI isotherm model and polar molecules following the Langmuir isotherm model (IUPAC type I). This study provides insight into how molecules are likely to adsorb on CNT surfaces and the impact on the local dielectric constant. This understanding has implications for the design and optimization of CNT-based sensors, particularly in detecting organic solvents and gases in various environments.

| S-EPMC11310837 | biostudies-literature

Designing a highly stable coordination-driven metallacycle for imaging-guided photodynamic cancer theranostics.

Project description:Coordination-driven self-assembly features good predictability and directionality in the construction of discrete metallacycles and metallacages with well-defined sizes and shapes, but their medicinal application has been limited by their low stability and solubility. Herein, we have designed and synthesized a highly stable coordination-driven metallacycle with desired functionality derived from a perylene-diimide ligand via a spontaneous deprotonation self-assembly process. Brilliant chemical stability and singlet oxygen production ability of this emissive octanuclear organopalladium macrocycle make it a good candidate toward biological studies. After cellular uptake by endocytosis, the metallacycle exhibits potent fluorescence cell imaging properties and cancer photodynamic therapeutic ability through enhancing ROS production, with high biocompatibility and safety. This study not only provides a rational design strategy for highly stable luminescent organopalladium metallacycles, but also sheds light on their application in imaging-guided photodynamic cancer therapy.

| S-EPMC8163381 | biostudies-literature

Solvent-assisted coordination driven assembly of a supramolecular architecture featuring two types of connectivity from discrete nanocages.

Project description:The rapid development of supramolecular chemistry provides a powerful bottom-up approach to construct various well-defined nano-architectures with increasing complexity and functionality. Compared to that of small and simple nanometric objects, the self-assembly of larger and more complex nanometric objects, such as nanocages, remains a significant challenge. Herein, we used a discrete nanocage as the monomer to successfully construct a novel three-dimensional (3D) supramolecular architecture, which comprises two types of nanocage building units with different connectivity, using the solvent-assisted coordination-driven assembly approach. The mechanism of this supramolecular assembly process was investigated by electrospray ionization mass spectrometry (ESI-MS) studies, which identified for the first time the formation of a nanocage dimer intermediate during the assembly process. The assembly of discrete nanocages into a 3D supramolecular architecture led to remarkable enhancement of stability and gas adsorption properties.

| S-EPMC6624976 | biostudies-literature

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

Tweets

OmicsDI Databases

PRIDE
PeptideAtlas
MassIVE
JPOST Repository
Physiome Model Repository

EGA
EVA
ENA
LINCS
PAXDB
Cell Collective

MetaboLights
Metabolomics Workbench
MetabolomeExpress
GNPS
BioModels
FAIRDOMHub

ArrayExpress
dbGaP
ExpressionAtlas
GEO
NODE

Information

Databases
Help
API
Contact us
Code on GitHub
Terms of use
Submit Data