Chemistry Commons^™

Understanding Students’ Global Interdependence In Science Instruction, Walter S. Smith

Journal of Global Education and Research

Multiple American educational organizations such as the National Education Association, Association for Supervision and Curriculum Development, and the Council of Chief State School Officers have advocated for globalizing the K-12 curriculum. The National Science Teaching Association (NSTA) in a position statement on international education and the Next Generation Science Standards have produced goals and standards for internationalizing the science curriculum by addressing topics such as climate change, environment, and disease that cross borders. In contrast to those pronouncements on the curriculum, this article views global science education through an instructional lens that focuses on a students’ global interdependence in science …

Headspace-Solid Phase Micro Extraction – Gas Chromatography – Mass Spectrometry (Hs-Spme-Gc-Ms) Analysis For Oak Barrel Flavor Compounds In Whiskey, Hailey F. Jarzynka

Chemistry & Biochemistry Theses - Archive

This study presents a method to simultaneously detect both fault compounds and oak barrel flavor compounds in whiskey using headspace-solid phase microextraction-gas chromatography-mass spectrometry (HS-SPME-GC-MS). A major contaminant in whiskey is geosmin and an array of oak barrel compounds includes 2-methoxy-4-methylphenol, 5-methylfurfural, guaiacol, trans-whiskey lactone, 2-methoxy-4-vinylphenol, 4-ethylguaiacol, eugenol, vanillin, and 4-ethylphenol. Geosmin is a fault compound that produces a musty or moldy taste to the whiskey and the other compounds originate from the barrels in which the whiskey is aged in and transfer to the whiskey in the aging process. Each compound was quantitated and 15 different whiskies were compared …

Volatiles Characterization During Whiskey Production Using Headspace - Solid Phase Microextraction - Gas Chromatography - Mass Spectrometry, Robert H. Magnuson

Chemistry & Biochemistry Theses - Archive

Whiskey is the second most consumed distilled alcoholic beverage type, by brand, on the planet behind Chinese Baijiu. A prominent component in many varieties of whiskey, maize, contributes a wide profile of compounds that undergo modification in the production pathway, ultimately influencing the final flavor profile. In this study, headspace/solid phase microextraction-gas chromatography/mass spectrometry (HS/SPME-GC/MS) was used to characterize the volatile profile of 5 different maize varieties, mashes produced from each, and 4 post-fermentation mixtures. Headspace sampling was performed using a high capacity SPME Arrow device, in an effort maximize the species detected. Compound identification was supplied by matches within …

Utilizing High Throughput Computing Techniques For The Predictions Of Spectroscopic Properties Of Astrophysically Relevant Molecules, Brian Ferrari

Electronic Theses and Dissertations, 2020-2023

Here, we utilize Quantum Chemistry (QC) approaches to predict the structures, vibrational frequencies, infrared intensities and Raman activities of unusual molecular species using the General Atomic and Molecular Structure System (GAMESS(US)) package. A Python-based software, AutoGAMESS, was developed to automate the workflow and take advantage of High Throughput Computing (HTC) techniques enabling the automated generation of spectroscopic data from hundreds of calculations. This approach was utilized to determine these properties for a series of carbon oxides (C2On; n = 3 to 4), anticipated to be produced during the radiation of pure carbon dioxide ices, under conditions relevant to the interstellar …

College Of Natural Sciences Newsletter, December 2021, College Of Natural Sciences

College of Natural Sciences Newsletters and Reports

Volume 2, Issue 12

Page 1 Dean's Message
Page 2 Awards & Recognition
Page 2 Media Coverage of CNS
Page 3 Media Coverage Cont.
Page 4 Science as Art Competition
Page 5 Open PRAIRIE Data
Page 5 Grants Awarded in CNS

Super-Adsorbent Hydrogels For Removal Of Methylene Blue From Aqueous Solution: Dye Adsorption Isotherms, Kinetics, And Thermodynamic Properties, Buddhabhushan Salunkhe, Thomas P. Schuman

Chemistry Faculty Research & Creative Works

Removal of dyes through adsorption from wastewater has gained substantial interest in recent years, especially in development of hydrogel-based adsorbents, owing to their easy use and economical nature. The aim of the present study was to design a super-adsorbent hydrogel based on sodium styrene sulfonate (NaSS) monomer for removal of dyes like methylene blue (MB). NaSS displays both an aromatic ring and strongly ionic group in its monomer structure that can enhance adsorption capacity. Poly (sodium styrene sulfonate-co-dimethylacrylamide) hydrogels were prepared by solution free radical polymerization using gelatin meth acryloyl (GelMA) as crosslinker, creating a highly porous, three-dimensionally crosslinked polymer …

Spectroscopic Studies Of The Interaction Between Phosphorus Heterocycles And Cytochrome P450, Dumei Ma, Libo Zhang, Yingwu Yin, Yuxing Gao, Qian Wang

Faculty Publications

P450 fatty acid decarboxylase OleT from Staphylococcus aureus (OleT_SA) is a novel cytochrome P450 enzyme that catalyzes the oxidative decarboxylation of fatty acids to yield primarily terminal alkenes and CO₂ or minor α- and β-hydroxylated fatty acids as side-products. In this work, the interactions between a series of cycloalkyl phosphorus heterocycles (CPHs) and OleT_SA were investigated in detail by fluorescence titration experiment, ultraviolet–visible (UV–vis) and ³¹P NMR spectroscopies. Fluorescence titration experiment results clearly showed that a dynamic quenching occurred when CPH-6, a representative CPHs, interacted with OleT_SA with a binding constant value of 15.2 …

Rational Design Of Multifunctional Nanocatalysts For Environmental Remediation And Energy Conversion Technologies, Md Ariful Ahsan

Open Access Theses & Dissertations

The discovery of efficient and sustainable carbon-based nanotechnologies to solve both the scarcity of drinking water and global energy crisis has become a paramount task in the last decades. Owed to the fast population growth and industrialization of the modern society, access to potable water and clean energy technologies is becoming very hard around the globe. Water pollutants have become a serious threat to the environment and ecology because of their toxic nature. Parallelly, the current hydrocarbon-based fuel industries are generating high levels of contamination across the planet, making imperative the development of cleaner energy technologies. In this regard, the …

Combination Of Nir Triggered Lanthanide Upconverting Nanoplatforms With Fullerene For Controlled Drug Release And Photo Cancer Therapy, Lei Ma

Open Access Theses & Dissertations

Photodynamic therapy (PDT) is an emerging, externally activatable, treatment modality for various diseases, especially for cancer therapy. Similar to radiotherapy, the mode of action with PDT involves the use of electromagnetic radiation to generate radical species in situ. However, PDT is a much milder approach for cancer treatment. Because of the unique physicochemical properties of fullerenes (such as C60), many potential biomedical applications, including PDT, became possible with them. As a main principle of PDT, the anticancer properties of various fullerene preparations usually result from their ability to generate cytotoxic reactive oxygen species (ROS), after photoexcitation. However, because of the …

Development Of Bioaffinity Based Assays For Forensic Applications, Juliana Maria Agudelo Cano

Legacy Theses & Dissertations (2009 - 2024)

In the field of forensic science, body fluids are a major contributor of evidence in investigations. However, body fluids are usually used only for their genetic content, overlooking its unique composition of proteins and low-molecular-weight compounds that often serve as biomarkers in clinical diagnostics. This investigation aimed to develop simple, effective, and economical models that can be used to identify different attributes of the originator. The focus of this research was to develop biocatalytic cascades that could analyze body fluids by using UV-Vis spectroscopy. These models could be implemented in forensic settings, as well as in biometric authentications. The central …

Development Of Visible-Light-Mediated Photoredox Catalysis, Sarbjeet Kaur

Legacy Theses & Dissertations (2009 - 2024)

ABSTRACT

Raman Spectroscopy For Forensic Identification Of Body Fluid Traces: Method Validation For Potential False Negatives Caused By Blood-Affecting Diseases, Niara Nichols

Chemistry

Two critical issues in forensic science are identifying body fluid traces found at crime scenes and preserving them for DNA analysis. However, the majority of current biochemical tests for body fluid identification, which are applicable at the crime scene, are presumptive and destructive to the sample. Raman Spectroscopy provides a suitable alternative to current methods as a nondestructive, confirmatory, and potentially in field method. Our laboratory has developed a chemometric model for the identification of five main body fluids using Raman spectroscopy. This model was developed using samples obtained from healthy donors. Thus, it is of most importance for the …

Temperature-Pressure Phase Diagrams Of Metal Nitrogen Compounds Through Density Functional Theory Computations And Thermodynamic Calculations, Hanof Alkhaldi

Chemistry & Biochemistry Dissertations - Archive

The need for novel materials for new generations of applications is growing tremendously. One of many pathways to attain new materials is the route of high pressure synthesis. A particular active area in this high–pressure research is to attain nitrogen-rich compounds. Many of these compounds discovered over the last decades have a potential use as hard material or as high–energy storage material. While it is not possible to predict a potential application for a compound before its experimental realization, it is worthy to explore beforehand what opportunities may exist. This kind of targeted development requires understanding of the synthesis process, …

Multinuclear Copper(I) And Silver(I) Pyrazolates: Synthesis, Luminescence, And Catalysis, Monika R. Patterson

Chemistry & Biochemistry Dissertations - Archive

Copper and silver pyrazolate complexes have numerous fascinating properties such as luminescence, catalytic ability, and complexation with small molecules. Using both more widely studied non-fluorinated pyrazolates and less common highly fluorinated pyrazolates as supporting ligands, we successfully synthesized and investigated several new coinage metal complexes. Synthetic details, structures, and properties i.e., luminescence and catalytic ability, have been studied. Chapter 2 of this research describes the synthesis of a new pyrazole with highly fluorinated aryl groups and corresponding trinuclear copper(I), silver(I), and gold(I) complexes. All three metal complexes exhibit bright blue luminescence under exposure to UV light. Additionally, the copper(I) complex …

Fluoroalcohol Induced Supramolecular Biphasic Systems Of Zwitterionic Surfactants, Mixed Amphiphiles, And Polar Organic Solvents In Proteomics And Environmental Analysis, Durga Khanal

Chemistry & Biochemistry Dissertations - Archive

In this research, we have investigated several HFIP-induced biphasic systems of zwitterionic surfactants like CHAPS and DMMAPS and their mixed amphiphilic systems for the extraction, enrichment, and fractionation of mixture of standard proteins and complex sample mixture of yeast proteins. The biphasic systems of zwitterionic surfactants (CHAPS and DMMAPS) and their mixed amphiphiles with quaternary ammonium salts (QUATS= TBAB, TEAB) provide concomitant extraction of hydrophobic membrane proteins, enrichment of lower abundance proteins to one phase, and fractionation of complex sample mixture into two phases. The results obtained from these biphasic systems were compared with control systems of aqueous solutions of …

8th Position Bodipy Chemistry, Laura I. Saucedo

Open Access Theses & Dissertations

The projects examined in this dissertation demonstrate how the meso substituents N and S lone pair-BODIPY core interaction influence the chemistry and properties of BODIPY fluorophores. Three objectives were completed experimentally and computationally. In the first project the meso amide substituent delocalizes the nitrogen lone pair into the carbonyl, preventing a hemicyanine resonance that causes blue emission in 8-amino-BODIPYs. The second and third projects substituting aniline or phenylthiol derivatives onto the 8th position, respectively. The aniline and phenylthio lone pair interaction with the BODIPY core can be modulated by electron-donating (ED) or –withdrawing (EW) moieties placed para on the aryl …

Identification Of Phosphorous Loading Point Source Facilities To 303(D) Listed Nutrient Impaired Waters Through Watershed Delineation Using Arcgis For Life Cycle Assessment Applications, John Zimmerman

Chemical Engineering Undergraduate Honors Theses

The work done for this project is part of a larger “life cycle assessment (LCA) of novel electrochemical phosphorus recovery technology at the wastewater treatment plant and U.S. watershed scales” (Morrissey 2019). The goal of that LCA is to determine “environmental impacts of implementing electrochemical struvite recovery at the wastewater treatment plant, U.S watershed, and global scales” (Morrissey 2019). This project’s goal is to identify locations deemed more sensitive to eutrophication impacts. The results will be used as part of the life cycle inventory (LCI) accounting for geographically explicit phosphorus flows. The waters identified as impaired were sourced from the …

A Tribute To Professor Gaetano Granozzi And His Contributions To Surface Science On The Occasion Of His 70th Birthday, Kurt W. Kolasinski

Chemistry Faculty Publications

On the occasion of his 70th birthday, we celebrate the career of our Editor-in-Chief, Professor Gaetano Granozzi. Prof. Granozzi’s work is marked by his dedication to the fundamental understanding of technologically relevant systems through the lens of surface science.

Is Bog Water Chemistry Affected By Increasing N And S Deposition From Oil Sands Development In Northern Alberta, Canada?, R. Kelman Wieder, Melanie A. Vile, Kimberli D. Scott, James C. Quinn, Cara M. Albright, Kelly J. Mcmillen, Caitlyn Herron, Hope Fillingim

Public Health Sciences Faculty Publications

Nitrogen and sulfur emissions from oil sands operations in northern Alberta, Canada have resulted in increasing deposition of N and S to the region's ecosystems. To assess whether a changing N and S deposition regime affects bog porewater chemistry, we sampled bog porewater at sites at different distances from the oil sands industrial center from 2009 to 2012 (10-cm intervals to a depth of 1 m) and from 2009 to 2019 (top of the bog water table only). We hypothesized that: (1) as atmospheric N and S deposition increases with increasing proximity to the oil sands industrial center, surface porewater …

Bioactivity Assessment Of Veratrum Californicum Alkaloids, Madison Dirks

Boise State University Theses and Dissertations

The native Idaho plant Veratrum californicum is known to contain steroidal alkaloids that function as inhibitors of hedgehog signaling, a pathway utilized for the growth and differentiation of cells as well as proper tissue development. Veratrum californicum was originally noticed when pregnant ewes consumed the plant and later gave birth to lambs with craniofacial mutations such as a cyclopean eyes. These malformations were caused by the plant’s steroidal alkaloid cyclopamine blocking the hedgehog signaling pathway. This same pathway is used by more than 20 types of cancer for multiplication of cells. Additional alkaloids have been found in Veratrum californicum, …

Fast & Efficient Simulation For Long Polymeric Chains, Naeyma N. Islam

LSU New Orleans Theses and Dissertations

No abstract provided.

Determining The Presence Of Biological Fluids In Peruvian Mummy Cloths Using The Liquid Chromatography Quadruple Time Of Flight Instrument, Tim Perksen, Joshua Sebree Ph.D.

Fall 2021 - Chemical Analysis Class Projects

A poster presenting the processes used and the results of analyzing the cloth from Peruvian mummies for the presence of biological fluids.

Identification Of Natural Dyes In Ancient Peruvian Mummy Cloths Using Lc/Ms/Ms, Shailah Mathews, Joshua Sebree Ph.D.

Fall 2021 - Chemical Analysis Class Projects

A poster presenting the processes used and the results of analyzing the natural dyes used on cloth from Peruvian mummies.

Detecting Oceanic Salt In Peruvian Mummy Cloths Using Scanning Electron Microscopy, Alexis Wirtz, Joshua Sebree Ph.D.

Fall 2021 - Chemical Analysis Class Projects

A poster presenting the processes and the results of analyzing cloth from Peruvian mummies for the presence of ocean salts.

Engineering Fluorescently Labeled Human Fibroblast Growth Factor One Mutants And Characterizing Their Photophysics Properties Towards Designing Fret Assays, Mamello Mohale

Graduate Theses and Dissertations

Human fibroblast growth factor one (hFGF1) belongs to a family of 22 FGF members produced by fibroblast cells. Cell signaling during physiological processes of angiogenesis and wound healing occurs when hFGF1 binds to its receptor (FGFR). However, when heterogenous homeostasis is not maintained, fibroblast cells exhibit excessive proliferation which can lead to a myriad of cancers. smFRET is an ultrasensitive distant dependent (1-10 nm) technique capable of resolving such heterogeneity in structural dynamics and binding affinities (Kd). Therefore, we successfully designed and characterized fluorescently labeled hFGF1 tracers which span the visible light region of the electromagnetic spectrum for use in …

Techniques For The Enantioselective Asymmetric Synthesis Of Benzyl Substituted Malonic Acid Esters, Madison Hansen

Honors Theses

A popular method for the enantioselective synthesis of substituted malonic half esters is hydrolysis via Pig Liver Esterase (PLE), however some substrates produce low enantiomeric excess, namely benzyl-substituted malonic esters. Presented here are alternative methods explored for this synthesis, the first being phase-transfer catalyzed hydrolysis via N-benzyl quaternary ammonium salts derived from cinchona alkaloids. The second method utilized chiral auxiliary directed benzylation with auxiliaries including menthol and oxazolidinones. Though unsuccessful, this research provided valuable groundwork in the investigation for the enantioselective asymmetric synthesis of benzyl-substituted malonic acid esters.

Keywords: Pig Liver Esterase, Enantioselectivity, Phase-Transfer Catalysis, Cinchona Alkaloids, Quaternary Ammonium …

Investigation Of N-Sulfonyliminium Ion Triggered Cyclizations For The Synthesis Of Piperidine Scaffolds, Kaitlyn Birkhoff

Honors Theses

In consideration of the on-going global pandemic, immediate access to Food and Drug Administration approved pharmaceutical medications and vaccines is a matter of utmost priority to our national healthcare system. One significant modality in managed care is the dispensation of prescription drugs for the prevention or treatment of illnesses and diseases. According to the Centers for Disease Control and Prevention, physicians order and provide over 2.9 billion prescriptions each year with analgesics, antihyperlipidemics, and dermatological agents being the most prescribed therapeutic classes. Within those classes exists a disparate variety of chemical structures that must be prepared on a metric ton …

Computational Investigations Of The Photochemical Properties Of B12-Dependent Systems: From Solution To Enzymes., Megan Toda Mackintosh

Electronic Theses and Dissertations

The photochemical properties of the B₁₂ family of molecules (cobalamins = Cbls) have been known for many years yet only until the 21^st century have applications for the light-sensitivity of Cbls come to the surface. Photolabile Cbls can be used for the delivery of therapeutics with spatial and temporal control, in the generation of hydroxyl radicals, and in nature, as demonstrated in the catalytic cycle of coenzyme B₁₂-dependent photoreceptors. This dissertation describes the use of computational methods to explore the photochemical properties of Cbl systems including antivitamins B₁₂, a thiolato-cobalamin, and the coenzyme B …

Conserved And Divergent Features Of Neuronal Camkii Holoenzyme Structure, Function, And Highorder Assembly, Olivia R. Buonarati, Adam P. Miller, Steven J. Coultrap, K. Ulrich Bayer, Steve L. Reichow

Chemistry Faculty Publications and Presentations

Neuronal CaMKII holoenzymes (^a and ^b isoforms) enable molecular signal computation underlying learning and memory but also mediate excitotoxic neuronal death. Here, we provide a comparative analysis of these signaling devices, using single-particle electron microscopy (EM) in combination with biochemical and live cell imaging studies. In the basal state, both isoforms assemble mainly as 12-mers (but also 14-mers and even 16-mers for the b isoform). CaMKIIa and ^b isoforms adopt an ensemble of extended activatable states (with average radius of 12.6 versus 16.8 nm, respectively), characterized by multiple transient intra- and interholoenzyme interactions associated with distinct functional properties. The …

Synthesis, Crystal Structure And Ionic Conductivity Of Ruddlesden-Popper Oxide Materials: Effects Of Ionic Radii And Defects On Lithium-Ionic Conductivity., Selorm Joy Fanah

Electronic Theses and Dissertations

Layered perovskite oxides of the Ruddlesden-Popper (RP) type structure can be good lithium-ion conductors for solid electrolyte applications in all-solid-state batteries, due to the large gap separating octahedral layers which can be useful pathways for Li-ion conduction. However, little work has been done on their lithium-ion transport properties in these materials despite their interesting structural properties. This work highlights the synthesis and study of the ionic conductivities in a series of n = 2 and 3 Ruddlesden-Popper oxides, as part of an ongoing investigation in search of alternative solid electrolyte materials. Several different strategies were employed for the enhancement of …