Chemistry Commons^™

Chemical Leeching Of Wood Sealents, Chloe Rippey, Luke Autrey, Ellisa Gene Catahan, Stephen Hobson

Liberty University Research Week

Undergraduate

Basic

Incorporating The Origin Of Life Theme In Organic Chemistry Laboratories: Analyses Of Amino Acids, Emmalyn Sarver, Michael R. Korn

Liberty University Research Week

Undergraduate

Basic

Design And Analysis Of A Novel Fluorescent Cell Stain, Simeon Standridge, Richard Sirard, Michael R. Korn

Liberty University Research Week

Undergraduate

Basic

Synthesis Of Some Rhenium-Pyridazyl Complexes For Future Use In Semiconductive Materials, Zachariah Hutcheon, Jonathan Nelson, Philip Temple, Mark Villers, Chad Snyder

Liberty University Research Week

Undergraduate

Basic

A Spectroscopic And Computational Study Of Diacetyl And Water Clusters, Margaret Baldwin

Honors Theses

Diacetyl, otherwise known as 1,2-butadione or biacetyl, is a flavor additive used in microwave popcorn, and more importantly as of late, e-cigarettes. The compound is known to cause lung disease for those who have been exposed to a large quantity of the buttery smelling molecule. As such, the characterization of diacetyl’s vibrational modes when it interacts with water are pivotal to understanding the effects it has on human lung tissue. In this research, the intermolecular interactions between water and diacetyl and the effects they have on one another’s vibrational modes are explored. While some experimental data is presented, the spectra …

Nitro Group Reduction For Use In Organic, Cathodic Materials, Brock G. Goeden

Honors Thesis

The industrial demand for higher capacity, light-weight battery materials has skyrocketed in recent years due to heavy investments in portable electronics, electronic vehicles, and renewable energy sources. However, rechargeable battery technology has seen little improvement since the invention of the Lithium-Ion battery in the 1980s. The low energy density of the traditionally utilized LiCoO2 cathodic material (specific capacity: 272 mAh g-1), has limited its potential to meet these increasing demands. To solve this problem, our research group is investigating new types of lightweight, organic, polymeric materials with conductive backbones as a possible replacement for the cathodic materials in Lithium-Ion batteries. …

Metal Foils With Ordered Crystal Structure And Method For Producing Metal Foils, Jay A. Switzer

Chemistry Faculty Research & Creative Works

A method for producing a metal foil comprising depositing metal onto an oxidizable substrate to form a metal film on the substrate; oxidizing the substrate at an interface between the metal film and the substrate; and removing the metal film from the substrate to yield a metal foil. A method for forming a thin metal film comprising pre-polarizing a single-crystal Si substrate by application of a potential which is negative of a potential at which Si oxidizes, which pre-polarization occurs in the presence of metal ions to form metal growth nucleation sites on the substrate, followed by application of a …

Human Ace2‑Functionalized Gold “Virus‑Trap” Nanostructures For Accurate Capture Of Sars‑Cov‑2 And Single‑Virus Sers Detection, Yong Yang, Yusi Peng, Chenglong Lin, Li Long, Jingying Hu, Jun He, Hui Zeng, Zhengren Huang, Zhi-Yuan Li, Masaki Tanemura, Jianlin Shi, John R. Lombardi, Xiaoying Luo

Publications and Research

The current COVID-19 pandemic urges the extremely sensitive and prompt detection of SARS-CoV-2 virus. Here, we present a Human Angiotensin-converting-enzyme 2 (ACE2)-functionalized gold “virus traps” nanostructure as an extremely sensitive SERS biosensor, to selectively capture and rapidly detect S-protein expressed coronavirus, such as the current SARS-CoV-2 in the contaminated water, down to the single-virus level. Such a SERS sensor features extraordinary 106- fold virus enrichment originating from high-affinity of ACE2 with S protein as well as “virus-traps” composed of oblique gold nanoneedles, and 109- fold enhancement of Raman signals originating from multicomponent SERS effects. Furthermore, the identification standard of virus …

Developing An Experiment For General Chemistry Ii, Tyler Fisher

Campus Research Month

I am presenting on my research in figuring out how the electrochem station works for the chemistry department. My goal is to standardize the machine and then design and create an experiment for General Chemistry II Lab.

Synthesis Of Dibenzophosphole Derivatives, Allan Roy Sison

Campus Research Month

This presentation will demonstrate how dibenzophosphole derivatives are synthesized. There will also be studies on the properties of this complex compound. Our experiment is based on previous studies on dibenzophospholes. We will be using the methods from the previous studies and we will synthesize the derivatives of the dibenzophosphole compound using other compounds such as dibromophenol.

"What Lights Up Your "Tech"? - Subtitle: Synthesis Of Polycyclic Aromatic Hydrocarbons (Pah) Using To 2,2-Dibromo-1,1-Binapthalene, Jefferd Daniel

Campus Research Month

The application of this molecule can be used eventually to add several elements like (Bromine, Chlorine, etc.) Previous done research that was conducted was in shortening the process to synthesize PAH. Since then, there has been research conducted to stabilize the compound by closing/linking two of the un-linked benzene rings.

Synthesize phosphyl-paralene, functionalize, and analyze the properties of those molecules and attach its derivatives

Synthesis Of Dibenzophospholes From Biphenyl, Claudia Velasquez

Campus Research Month

The aim is a direct synthesis of various diphenzylphospholes using biphenyl, phosphonic acid, and Tf2O. Successful addition of the phosphonic acid in a one step reaction would result in a more efficient production of the diphenylphospholes.

Dibenzophosphole Synthesis From 4-4’-Ditertbutyl-1,1’-Biphenyl By Double C-P Bond Formation, Annette Echevarria

Campus Research Month

No abstract provided.

Products Of An Acid-Catalyzed 1-Methylcyclopentene Reaction, Erin Burke

Campus Research Month

The poster presents research on the alternate products produced from 1-methylcyclopentene across different concentrations of sulfuric acid catalyst.

Squaramide Structure And Interactions With Benzene, Serina Tressler

Undergraduate Research and Scholarship Symposium

The chemical industry’s continued reliance on expensive and toxic metal catalysts has driven the search for greener and more sustainable alternatives. One such option is hydrogen bonding organocatalysts, a group of inexpensive compounds made from renewable feedstocks. However, the interactions of these compounds with aryl groups is not currently understood, limiting their overall effectiveness. Dual hydrogen bond donors such as squaramide and thiourea have been a focus of study for some time, but the structure and interactions of unsubstituted squaramide have not been thoroughly reported and present an unknown in catalyst design. This study seeks to understand the structure of …

The Supercam Instrument Suite On The Mars 2020 Rover: Science Objectives And Mast-Unit Description, S. Maurice, R. C. Wiens, P. Bernardi, P. Caïs, S. Robinson, T. Nelson, O. Gasnault, J. -M. Reess, M. Deleuze, F. Rull, J. -A. Manrique, S. Abbaki, R. B. Anderson, Y. André, Stanley M. Angel, G. Arana, T. Battault, P. Beck, K. Benzerara, S. Bernard, Et. Al.

Faculty Publications

On the NASA 2020 rover mission to Jezero crater, the remote determination of the texture, mineralogy and chemistry of rocks is essential to quickly and thoroughly characterize an area and to optimize the selection of samples for return to Earth. As part of the Perseverance payload, SuperCam is a suite of five techniques that provide critical and complementary observations via Laser-Induced Breakdown Spectroscopy (LIBS), Time-Resolved Raman and Luminescence (TRR/L), visible and near-infrared spectroscopy (VISIR), high-resolution color imaging (RMI), and acoustic recording (MIC). SuperCam operates at remote distances, primarily 2–7 m, while providing data at sub-mm to mm scales. We report …

Gcn5-Related N-Acetyltransferases (Gnats) With A Catalytic Serine Residue Can Play Ping-Pong Too, Jackson T. Baumgartner, Thahani S. Habeeb Mohammad, Mateusz P. Czub, Karolina A. Majorek, Xhulio Arolli, Cillian Variot, Madison Anonick, Wladek Minor, Miguel A. Ballicora, Daniel P. Becker Ph.D., Misty L. Kuhn

Chemistry: Faculty Publications and Other Works

Enzymes in the Gcn5-related N-acetyltransferase (GNAT) superfamily are widespread and critically involved in multiple cellular processes ranging from antibiotic resistance to histone modification. While acetyl transfer is the most widely catalyzed reaction, recent studies have revealed that these enzymes are also capable of performing succinylation, condensation, decarboxylation, and methylcarbamoylation reactions. The canonical chemical mechanism attributed to GNATs is a general acid/base mechanism; however, mounting evidence has cast doubt on the applicability of this mechanism to all GNATs. This study shows that the Pseudomonas aeruginosa PA3944 enzyme uses a nucleophilic serine residue and a hybrid ping-pong mechanism for catalysis instead …

Development Of A Rapid Drug Detection Method For Insects Using Paper Spray Ionization Mass Spectrometry (Psi-Ms), Alexandria Plyler

Undergraduate Research and Scholarship Symposium

Insects have the ability to reflect the chemical environment that they have developed in. Thus, necrogenous insects can reflect the chemical environment of cadavers they have fed on. Forensic scientists can potentially utilize insect larvae as an alternate biological matrix to detect drugs in cadavers that are skeletonized, burned, or otherwise badly damaged. Analysis of insects using paper spray ionization mass spectrometry (PSI-MS), an analytical method requiring little to no sample preparation, could prove a rapid, cost-effective, and non-destructive alternative form of toxicological analysis. Traditional tissue analysis via GC and LC-MS often require lengthy sample preparation, use expensive reagents, and …

Kathmandu Nepal - 1993

World Data - Asia

Relevant Publications

Environmental Science & Technology Publication (1995)

Thessaloniki Greece - 1992

World Data - Europe

Relevant Publications

Environmental Science & Technology Publication (1995)

3rd International Symposium: Transport and Air Pollution (1994)

Synthesis And Characterization Of Regioregular Cross-Conjugated Poly(Thienylene Vinylene)S, Yousef M. Katba Bader

Chemistry and Chemical Biology ETDs

Poly(thienylene vinylene)s (PTVs) is special a class of conjugated polymers (CPs) that show remarkable optoelectronic properties and promising applications. The main reason that hinders their application, is the lack of synthetic methodologies for preparing new derivatives with various functionality. Developing new PTVs with improved structures based on structure-property relationships increases the potential of utilizing this type of polymers in advanced applications. Most available preparation methods lead to regio-random PTVs (ra-PTVs) structures due to the different placement of the sidechain in the polymer backbone, which results in reduced crystallinity. In this study, we developed a novel strategy that produces a series …

Theoretical Investigation Of In2h2 And Tl2h2 And Their Relationship To Other Group 13 Metal Dihydrides, Caroline Sargent

Student Scholarship

Four constitutional isomers{ dibridged, monobridged, vinylidene-like, and trans{ of group 13 metal dihydrides have been reviewed and studied by theoretical methods. Equilibirum structures, relative enthalpies, and vibrational spectroscopic information is presented for isomers of Al2H2, Ga2H2, In2H2, and Tl2H2. Properties of the isomers of Al2H2 and Ga2H2 were obtained from previous studies.1{3 Properties of In2H2 and Tl2H2 were calculated using rigorous ab initio theory, and the results are presented. …

Broken-Hearted” Carbon Bowl Via Electron Shuttle Reaction: Energetics And Electron Coupling, Gabrielle A. Leith, Allison M. Rice, Brandon J. Yarbrough, Preecha Kittikhunnatham, Abijai Mathur, Nicholas A. Morris, Megan J. Francis, Anna A. Berseneva, Poonam Dhull, Richard D. Adams, M. Victoria Bobo, Aaron A. Vannucci, Mark D. Smith, Sophya Garashchuk, Natalia B. Shustova

Faculty Publications

Unprecedented one-step CC bond cleavage leading to opening of the buckybowl (π-bowl), that could provide access to carbon-rich structures with previously inaccessible topologies, is reported; highlighting the possibility to implement drastically different synthetic routes to π-bowls in contrast to conventional ones applied for polycyclic aromatic hydrocarbons. Through theoretical modeling, we evaluated the mechanistic pathways feasible for π-bowl planarization and factors that could affect such a transformation including strain and released energies. Through employment of Marcus theory, optical spectroscopy, and crystallographic analysis, we estimated the possibility of charge transfer and electron coupling between “open” corannulene and a strong electron acceptor such …

Anion–Anion Interactions In Aerogen-Bonded Complexes. Influence Of Solvent Environment, Anna Grabarz, Mariusz Michalczyk, Wiktor Zierkiewicz, Steve Scheiner

Chemistry and Biochemistry Faculty Publications

Ab initio calculations are applied to the question as to whether a AeX₅− anion (Ae = Kr, Xe) can engage in a stable complex with another anion: F−, Cl−, or CN−. The latter approaches the central Ae atom from above the molecular plane, along its C₅ axis. While the electrostatic repulsion between the two anions prevents their association in the gas phase, immersion of the system in a polar medium allows dimerization to proceed. The aerogen bond is a weak one, with binding energies less than 2 kcal/mol, even in highly polar aqueous solvent. The complexes are …

Exploring The Effects Of Various Growth Conditions On Gene Expression Of Mechanosensitive Ion Channels In Escherichia Coli, Sarah C. Johnson, Hannah R. Malcolm

Showcase of Osprey Advancements in Research and Scholarship (SOARS)

In rapidly changing environmental conditions, bacterial mechanosensitive ion channels are responsible for ensuring cell survival. Bacterial mechanosensitive channels gate in response to membrane tension in order to relieve intracellular pressure, prior to cell lysis. The most well-studied bacterial mechanosensitive channels include the mechanosensitive channel of large (MscL) and small (MscS) conductance from Escherichia coli (E. coli), both of which gate in response to tension. In E. coli, there are seven mechanosensitive ion channel genes: MscL, MscS, and five additional genes that are members of the MscS superfamily. Of these seven genes, six have been shown to gate directly in response …

Synthesis And Validation Of Substrates For Prmt1 Using Plate-Based Screening Assay, Tina Sawatzky, Sarah Mann, Bryan Knuckley

Showcase of Osprey Advancements in Research and Scholarship (SOARS)

PRMT (Protein Arginine Methyltransferase) is a mammalian enzyme that catalyzes methylation of arginine residues in a polypeptide chain. PRMT is categorized as 3 different types. The methylation can occur as asymmetric dimethylation (ADMA, PRMT 1, 2, 3, 4, 6, and 8), symmetric dimethylation (SDMA, PRMT 7, 5 and 9) or monomethylation (MMA, PRMT 7), Type I, II and III respectively. PRMT1 generates ADMA on arginine residues of the Histone H4 N-terminal tail, which can lead to transcription of cancer-related genes. Alternatively, PRMT5 can modify the same arginine residue to produce SDMA, which represses the development of those same cancer-related genes. …

Determination Of The Traits In Leguminous Crops Under Saline Condition, Tojiddin Kuliev, Karomat Ismailova

Karakalpak Scientific Journal

In this study, the variability and determination of genetic traits for winter legume crop varieties the Vostok-55 (Pisum arvense L) and Mirzachul-1 (Vicia villoza Roth L) were investigated under moderate saline soil condition. Results show that the weight of the bean was marked as variable and highly deterministic, and the height of the plants was the most stable. The selection of plants based on these traits is the most effective way of salinity. Both variety the forage pea Vostok-55 and vetch Mirzachul-1 is highly recommended as a sideration and forage crop in saline lands.

Synthesis Of The Microbial Polysaccharide Gellan From Dairy And Plant-Based Processing Coproducts, Thomas P. West

Faculty Publications

The purpose of this review is to provide both background about the microbial polysaccharide gellan and, more specifically, to examine bacterial gellan synthesis on dairy and plant-based processing coproducts. The anionic heteropolysaccharide gellan is known to be synthesized by Sphingomonas elodea strain ATCC 31461 [1,2]. Although originally classified as Pseudomonas elodea, this strain was reclassified as a species of Sphingomonas [3,4]. Structurally, the water-soluble gum gellan exists as a tetrasaccharide composed of 20% glucuronic acid, 60% glucose and 20% rhamnose [5–7]. The native form of gellan has been shown to contain acetyl and L-glyceryl groups. These substituents need to be …

Ratiometric Near-Infrared Fluorescent Probes Based On Hemicyanine Dyes Bearing Dithioacetal And Formal Residues For Ph Detection In Mitochondria, Yunnan Yan, Yibin Zhang, Shuai Xia, Shulin Wan, Tara Vohs, Marina Tanasova, Rudy Luck, Haiying Lui

Michigan Tech Publications, Part 1

Ratiometric near-infrared fluorescent probes (AH+ and BH+) have been prepared for pH determination in mitochondria by attaching dithioacetal and formal residues onto a hemicyanine dye. The reactive formyl group on probe BH+ allows for retention inside mitochondria as it can react with a protein primary amine residue to form an imine under slightly basic pH 8.0. Probes AH+ and BH+ display ratiometric fluorescent responses to pH changes through the protonation and deprotonaton of a hydroxy group in hemicyanine dyes with experimentally determined pKa values of 6.85 and 6.49, respectively. Calculated pKa values from a variety of theoretical methods indicated that …

Protonation Of Methyl Phenyl Porphyrin Isomers Using Uv Spectroscopy, Mamiko Swanson, Isabel De Angelis, Harsh Chheda, Rushi Patel, Raahil Shah, Shreya Patel, Maria Ballester Ph.D.

Chemistry and Physics Faculty Proceedings, Presentations, Speeches, Lectures

The protonation of methyl phenyl porphyrin isomers was studied through UV vis spectroscopy using trifluoroacetic acid (TFA), a strong organic acid. Protonation was achieved by titration of the porphyrin in toluene and toluene/methanol (90:10). A wavelength shift from the free base Soret to the protonated Soret confirms the formation of the dication. The resulting UV spectra was used to calculate an apparent pKa value of each free base porphyrin isomer. Addition of methanol to the porphyrin solution decreased the average pKa values of the Soret and Q-bands for each porphyrin. This could be an indication of a stabilizing monocation, not …