Article
Biochemistry & Molecular Biology
Ida Fejos, Eszter Kalydi, Edit Luca Kukk, Mimimorena Seggio, Milo Malanga, Szabolcs Beni
Summary: This study investigated the chiral recognition mechanisms of positively charged cyclodextrin derivatives through synthesis, pH determination, and chiral capillary electrophoretic studies. The results indicated that these derivatives can be effective chiral selectors for discriminating between various model racemates. The study also found that substituent-dependent enantiomer migration order reversal occurred in certain cyclodextrins.
Article
Biochemical Research Methods
Wenhui Li, Yu Huang, Yuqian Xiang, Xiaohui Yan, Yanshuo Li, Dapeng Wu
Summary: A vacuum-assisted thermal bonding method was proposed for the covalent coupling of beta-cyclodextrin (CD-CSP), hexamethylene diisocyanate cross-linked beta-CD (HDI-CSP) and 3, 5-dimethylphenyl isocyanate modified beta-CD (DMPI-CSP) onto isocyanate silane modified silica gel. The method avoided side reactions under vacuum conditions and achieved optimal temperature and time of 160 degrees C and 3 h. The three CSPs exhibited good chromatographic performance, with CD-CSP achieving separation of all 7 flavanones enantiomers and HDI-CSP showing good separation performance for triazoles enantiomers with one chiral center.
JOURNAL OF CHROMATOGRAPHY A
(2023)
Article
Chemistry, Physical
Dongdi Wang, Jiawei Xue, Xilan Ding, Jie Wei, Chen Feng, Ruyang Wang, Peiyu Ma, Sicong Wang, Heng Cao, Jingyan Wang, Ming Zuo, Shiming Zhou, Zhirong Zhang, Jie Zeng, Jun Bao
Summary: Single-atom catalysts with particular neighboring geometry can enhance the activity of reaction intermediates and improve catalytic performance. In this study, a neighboring cationic vacancy strategy in single-atom Ru catalysts was proposed to adjust the adsorption configuration of reaction intermediates for improved oxygen evolution performance. Experimental and computational results confirmed the effectiveness of this strategy.
Article
Engineering, Chemical
Yizhihao Lu, Huacheng Zhang, Shasha Liu, Fanmengjing Wang, Mark M. Banaszak Holl, Philip J. Marriott, Huanting Wang
Summary: In this study, cyclodextrins (CDs) were used as building blocks to fabricate a microporous polyester layer superposed on a cellulose nanofiber (CNF) layer through an interfacial polymerization method. The resulting composite membrane showed ultimate enantioselectivity and the highest flux.
JOURNAL OF MEMBRANE SCIENCE
(2022)
Article
Chemistry, Analytical
Ondrej Horacek, Monika Papajova-Janetkova, Bohumir Gruner, Lukas Lochman, Petra Sterbova-Kovarikova, Radim Vespalec, Radim Kucera
Summary: The chiral separations of stable anionic boron cluster derivatives with asymmetric substitutions remain a challenge in chiral chromatography, but this study successfully achieved the first-ever HPLC enantioseparations of 7,8-dicarba-nido-undecaborates(1-) by blocking cationic sites on the stationary phase. Brominated beta-cyclodextrin showed better chiral selectivity for separation of these species, providing new insights into chiral separation of anionic boron clusters.
Article
Biochemical Research Methods
Mari-Luiza Konjaria, Rusudan Kakava, Alessandro Volonterio, Bezhan Chankvetadze, Gerhard K. E. Scriba
Summary: This study evaluated the enantioseparation of 16 chiral compounds using capillary electrophoresis with charged cyclodextrins as chiral selectors. It found that randomly substituted cyclodextrins showed good separation ability for the model analytes. The study also discovered the influence of complexation constants and complex mobilities on the migration order of enantiomers.
JOURNAL OF CHROMATOGRAPHY A
(2022)
Article
Chemistry, Analytical
Yiqun Li, Lin Zhao, Jiayi Li, Shanshan Xie, Ning Liang
Summary: A gamma-Cyclodextrin based metal-organic framework with D-Histidine as a chiral ligand was synthesized for the selective enrichment of S-Naproxen enantiomer. Computer simulations predicted intermolecular binding patterns and the difference in affinity due to the differentiation in pi-lone pair miscellaneous and hydrogen bonding force capacities. This chiral adsorption material shows great potential as a chiral resolution agent.
MICROCHEMICAL JOURNAL
(2023)
Article
Chemistry, Inorganic & Nuclear
Rajeh Alotaibi, Edmund Little, Jonathan M. Fowler, Adam Brookfield, Ralph W. Adams, Amritroop Achari, Grigore A. Timco, George F. S. Whitehead, Nicholas F. Chilton, Rahul R. Nair, David Collison, Richard E. P. Winpenny
Summary: A family of heterometallic rings with octagonal metal cores bridged by fluoride and carboxylate ligands has been reported, using tetramethylammonium hydroxide pentahydrate as a template source. Magnetic studies reveal antiferromagnetic coupling between different paramagnetic metal ions, resulting in paramagnetic ground states. These structures have been confirmed through H-1 NMR and electron paramagnetic resonance spectroscopy.
INORGANIC CHEMISTRY
(2021)
Article
Chemistry, Multidisciplinary
Michael Kemper, Deborah A. Drost, Elric Engelage, Christian Merten
Summary: This article investigates the strength and role of a special kind of hydrogen bond called dihydrogen bond (DHB) in the self-aggregation of amine-borane adducts. The study shows that the stereochemistry at the nitrogen significantly influences the interaction enthalpy, suggesting that N-chiral amine boranes can be used to fine-tune the formation dynamics of assemblies in supramolecular chemistry.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
(2022)
Article
Chemistry, Multidisciplinary
Ning Zhang, Siyu Guo, Bolin Gong
Summary: A novel bridged bis(beta-cyclodextrin) chiral stationary phase (HTCDP) was synthesized for the first time, showing superior enantiomer separation and chiral recognition abilities. By optimizing chromatographic conditions, HTCDP successfully separated 19 analytes with high resolution, outperforming the native beta-CD chiral stationary phase (CDCSP).
Article
Chemistry, Multidisciplinary
Alessandro Triolo, Fabrizio Lo Celso, Sophie Fourmentin, Olga Russina
Summary: The concept of supramolecular solvents has led to the development of supramolecular deep eutectic solvents (SUPRA-DES), which have an extended liquid-state window and enhanced solvation effectiveness. A joint experimental and computational study on an archetypal SUPRA-DES provides insight into its structural organization and interaction mechanisms, leading to the potential to expand the range of sustainable applications for these unique solvents.
ACS SUSTAINABLE CHEMISTRY & ENGINEERING
(2023)
Article
Chemistry, Physical
Rafael M. Madero-Castro, Sofia Calero, A. Ozgur Yazaydin
Summary: Dehydration of bioalcohols is a major cost factor in biofuel production, and this study investigates the liquid phase separation of water from methanol and ethanol in a siliceous MFI pervaporation membrane. Molecular dynamic simulations show that hydrogen bonding between water and alcohol molecules may hinder complete alcohol selectivity, but suggest the potential for functionalizing membrane surfaces to overcome this issue and improve separation efficiency.
JOURNAL OF MOLECULAR LIQUIDS
(2021)
Review
Chemistry, Multidisciplinary
Gengwu Zhang, Yanjun Ding, Abdulmajeed Hashem, Aliyah Fakim, Niveen M. Khashab
Summary: Xylene mixtures and the three individual isomers are valuable chemical feedstocks in the chemical industry, but their separation is challenging. Traditional separation technologies are not suitable for sustainable development, while adsorption by porous materials is proposed as an alternative strategy. Intrinsically porous molecular materials have been used for energy-intensive separations due to their high efficiency and low energy consumption.
CELL REPORTS PHYSICAL SCIENCE
(2021)
Article
Chemistry, Physical
Ang Li, Siru Ren, Chuanjiang Teng, Hongmei Liu, Qi Zhang
Summary: Deep eutectic solvents (DESs) have potential applications as additives/modifiers in chiral electrokinetic chromatography (EKC) and can moderately improve the enantioseparation performance. The improvement is mainly attributed to the contribution of hydrogen-bond acceptors (HBAs) rather than hydrogen-bond donors (HBDs). However, using chiral DESs does not show obvious advantages compared to achiral DESs, which is different from the performance of chiral ionic liquids (ILs) as additives in chiral EKC.
JOURNAL OF MOLECULAR LIQUIDS
(2022)
Article
Chemistry, Physical
Maria Asghar, Ahmed Lakhani, Misbah Asif, Nadeem S. Sheikh, Muhammad Ali Hashmi, Ralf Ludwig, Hassan H. Hammud, Khurshid Ayub
Summary: In this study, CC2 cages were used to discriminate amino acids based on their chirality. The results showed that amino acids were physisorbed in the central cavity of the cage. Proline exhibited the strongest interaction with the cage and the highest chiral discrimination energy of 2.78 kcal/mol. The analysis also revealed that the S enantiomer had the maximum interactions in each case.
JOURNAL OF PHYSICAL CHEMISTRY A
(2023)
Article
Chemistry, Multidisciplinary
Xinlei Wang, Jijun Xiao, Weihua Tang
Summary: The study presents the design of polymer cathodes for highly efficient and robust aqueous zinc-ion batteries, investigating the impact of pendant configuration on their performance. It demonstrates potential for large-scale applications by showing outstanding molecular planarity and reversible redox reaction of the hydroquinone-derived cathode.
ADVANCED FUNCTIONAL MATERIALS
(2022)
Article
Engineering, Environmental
Linqiang Yang, Hongtao Wang, Jinru Cao, Fuqiang Du, Jiangsheng Yu, Weihua Tang
Summary: Chemical modification of thieno[2'(,),3'(,) : 5',6']-s-indaceno[2',1' :4, 5]thieno[3,2-b]thieno[2,3-d] pyrrole cored fused-ring electron acceptors (FREAs) with different substituents allows for fine-tuning surface electrostatic potentials and aggregation behaviors, leading to improved performance in as-cast OSCs. The addition of 10 wt% PC71BM to PM6:IMOF (1:1.2) blend increases the PCE to 14.42%, showcasing the enhanced crystallinity and aggregation of IMOF compared to other acceptors.
CHEMICAL ENGINEERING JOURNAL
(2022)
Article
Engineering, Environmental
Hongtao Wang, Fuqiang Du, Jinru Cao, Jiangsheng Yu, Xin Liu, Weihua Tang
Summary: High-performance ternary semitransparent organic solar cells (ST-OSCs) are achieved by incorporating low structure order DCB-4F into PM6:DTPSe-4Cl host blend. The addition of DCB-4F enhances molecular arrangement for enhanced charge transport in active layers, leading to outstanding power conversion efficiencies of 15.93% and 12.58% for corresponding opaque and semitransparent ternary OSCs.
CHEMICAL ENGINEERING JOURNAL
(2022)
Article
Engineering, Environmental
Jinru Cao, Hongtao Wang, Linqiang Yang, Fuqiang Du, Jiangsheng Yu, Weihua Tang
Summary: Fluorinated noncovalently fused-ring electron acceptors (NFREAs) are commonly used in high-performing organic solar cells (OSCs) due to their better performance compared to the chemically cheaper chlorinated ones. By modulating central side chains, three novel chlorinated NFREAs were synthesized and one of them, DBT-HD, exhibited better performance in terms of efficient exciton dissociation and charge transport when blended with PBDB-T. This resulted in achieving a champion power conversion efficiency (PCE) and fill factor (FF) for PBDB-T:DBT-HD based devices among the highest values reported in literature for NFREAs based binary OSCs.
CHEMICAL ENGINEERING JOURNAL
(2022)
Review
Chemistry, Physical
Wanhai Wang, Jie Zhou, Weihua Tang
Summary: This review discusses recent advances in undoped hole transport materials (HTMs) for perovskite solar cells, proposes design strategies for improving the performance of PVSCs, and examines the correlation between molecular structures and device performance and stability. The development of dopant-free small organic HTMs is considered a promising approach for achieving efficient and stable PVSCs towards commercialization.
JOURNAL OF MATERIALS CHEMISTRY A
(2022)
Article
Materials Science, Multidisciplinary
Dianlei Fang, Xinlei Wang, Shijie Zhang, Lingyan Sheng, Jian Tang, Jie Zhou, Weihua Tang
Summary: The study presents a facile method for synthesizing CMPs, resulting in 3Qn-CMP and 3Qn-CMP/rGO hybrids with exceptional energy storage capacity and cycling stability. These materials feature dual redox active sites and efficient charge conduction, making them suitable for applications in electrochemical energy storage.
SCIENCE CHINA-MATERIALS
(2022)
Article
Chemistry, Multidisciplinary
Xinlei Wang, Jian Tang, Weihua Tang
Summary: This study designs and prepares triquinoxalinylene-based polymers for zinc-ion batteries, demonstrating good performance. The impact of molecular configuration on zinc ion transfer and coordination dynamics is investigated, revealing the mechanisms. Notably, the polymer P3Q-t exhibits faster reaction dynamics, lower zinc ion transfer resistance, and high capacity and cycling stability.
ADVANCED FUNCTIONAL MATERIALS
(2022)
Article
Chemistry, Multidisciplinary
Yue Liu, Zhijie Lin, Jinru Cao, Fuqiang Du, Hongtao Wang, Shi He, Weihua Tang
Summary: This study reports four unfused-ring acceptors (UFAs) with different molecular frameworks, which are used to fabricate high-efficiency organic solar cells (OSCs) with wet films. These UFAs exhibit strong near-infrared absorption and narrow optical band gap, and when blended with polymer donors, they promote efficient charge transport. Experimental and theoretical simulations demonstrate the impact of the molecular framework of UFAs on their performance.
Article
Chemistry, Multidisciplinary
Tanveer Farid, Yiyun Wang, Muhammad Imran Rafiq, Amjad Ali, Weihua Tang
Summary: A facile method to synthesize porous flexible conductive wood for high-performance energy storage is reported. The treated wood scaffolds exhibit high flexibility and excellent mechanical strength, with improved electron/ion transport facilitated by the deposition of carbon nanotubes.
ACS SUSTAINABLE CHEMISTRY & ENGINEERING
(2022)
Article
Chemistry, Physical
Xinlei Wang, Jie Zhou, Zhipeng Li, Weihua Tang
Summary: We report two redox polymers (PHATN-t and PHAT-t) with extended pi-conjugated structures. Their potential as high-rate electrodes in zinc-ion supercapatteries (ZIS) has been systematically studied through experimental tests and theoretical calculations. PHATN-t and PHAT-t show maximum specific capacities of 190 and 171 mA h g(-1) at 0.3 A g(-1), which remain at 132 and 121 mA h g(-1) at 10 A g(-1), respectively. Importantly, PHATN-t and PHAT-t exhibit capacity retentions of 86.8% and 77.6% after 1000 cycles.
JOURNAL OF MATERIALS CHEMISTRY A
(2023)
Article
Biochemistry & Molecular Biology
Hualei Zhang, Xinlei Wang, Jie Zhou, Weihua Tang
Summary: In this study, the researchers developed flexible electrodes by incorporating azo-linkage redox metal-organic frameworks (MOFs) with single-walled carbon nanotubes (CNTs). The resulting hybrid material, CNT@UiO-66-AQ, showed greatly improved conductivity, charge storage pathways, and electrochemical dynamics. It exhibited high capacitance and excellent cycling stability, outperforming other MOFs-hybrids-based supercapacitors reported in the literature. This work opens up new possibilities for the preparation of high-performance robust aqueous energy storage materials using azo-coupled redox MOFs hybrids with carbonaceous substrates.
Article
Chemistry, Physical
Amjad Ali, Tanveer Farid, Muhammad Imran Rafiq, Baojing Zhou, Weihua Tang
Summary: This study evaluates the effect of Hartree-Fock exact exchange on the calculation of maximum absorption wavelengths and vertical excitation energies using time-dependent density functional theory. The results show that different methods with varying HFX ratios have different performances, while methods with the same ratio perform similarly. Additionally, the APF and APFD methods have the smallest deviations for all compounds.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2022)
Article
Materials Science, Multidisciplinary
Zhijie Lin, Fuqiang Du, Hongtao Wang, Jinru Cao, Weihua Tang
Summary: In this study, a simple unfused-ring electron acceptor (ThPF-4F) was developed for high-efficiency layer-by-layer (LBL) organic solar cells (OSCs). Compared to conventional bulk-heterojunction (BHJ) OSCs, LBL OSCs showed a better vertical gradient distribution of the donor and acceptor in the active layers, resulting in improved charge transport efficiency. The performance of LBL OSCs was further enhanced by adding 10 wt% PC71BM in the donor layer.
JOURNAL OF MATERIALS CHEMISTRY C
(2022)
Article
Chemistry, Physical
Yiyun Wang, Xinlei Wang, Jian Tang, Weihua Tang
Summary: This study developed a novel organic cathode TTPQ, which achieved superior electrochemical performance for AZIBs with high energy storage capacity and cycle stability.
JOURNAL OF MATERIALS CHEMISTRY A
(2022)
Review
Chemistry, Physical
Tanveer Farid, Muhammad Imran Rafiq, Amjad Ali, Weihua Tang
Summary: Wood, an ecofriendly and renewable material, has been modified extensively to preserve its natural structure and fiber direction, providing excellent opportunities for material infiltration and densification. Its hierarchical structure and biocompatibility, combined with cutting-edge processings, have explored vast applications and potentials as a next-generation material.