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2003

Chemistry

Selected Works

Articles 1 - 18 of 18

Full-Text Articles in Physical Sciences and Mathematics

Non-Steady-State Approach #11;To Steady-State Kinetics: #11;Case Study Of H2s Oxidation By Oxygen, Andrey N. Zagoruiko, Vladimir V. Mokrinskii Nov 2003

Non-Steady-State Approach #11;To Steady-State Kinetics: #11;Case Study Of H2s Oxidation By Oxygen, Andrey N. Zagoruiko, Vladimir V. Mokrinskii

Andrey N Zagoruiko

Non-steady-state kinetic models may be used for treatment of steady-state kinetic data in case when algebraic elaboration of steady-state kinetic equations is impossible or complicated. The proposed approach includes numerical integration of time-dependent differential equations until achievement of steady-state, resulting in possibility to numerically obtain the rate values for separate reaction stages for given composition of reaction mixture. The obtained non-steady-state model may be then applied in simulation of catalyst pellets and catalyst beds in research and engineering purposes. The case study demonstrates application of such approach for steady-state kinetic description of complicated reaction system of H2S oxidation by oxygen. …

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Rust, Glue, And Molecules -- Understanding The Role Of Molecular Structure On Macroscopic Interfacial Properties, Mark Anderson Oct 2003

Rust, Glue, And Molecules -- Understanding The Role Of Molecular Structure On Macroscopic Interfacial Properties, Mark Anderson

Mark R. Anderson

No abstract is available at this time.

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Hall And Wolynes Reply [Reply To Comment On ‘‘Microscopic Theory Of Network Glasses’’], Randall W. Hall, Peter G. Wolynes Oct 2003

Hall And Wolynes Reply [Reply To Comment On ‘‘Microscopic Theory Of Network Glasses’’], Randall W. Hall, Peter G. Wolynes

Randall W. Hall

In a Comment on our recent paper on network glasses (Phys. Rev. Lett., 2003, 90, 085505), Micoulaut and Boolchand (MB) compare our predictions on glass transitions in network systems for the ratios of the transition temperatures TA/TG and TK/TG with experimental data. They claim significant differences between experiment and theory are seen and claim the lack of agreement is due to flaws in our theory. Their comparison of TA/TG is incorrect as they do not measure the same quantity that our theory predicts. The TK/TG comparison shows remarkable agreement between theory and experiment.

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Targeting The Transcriptional Machinery With Unique Artificial Transcriptional Activators, Brian Brennan, Zhiqian Wu, Garrette Belanger, Jenifer Lum, Aaron Minter, Steven Rowe, Annette Plachetka, Chinmay Majmudar, Anna Mapp Sep 2003

Targeting The Transcriptional Machinery With Unique Artificial Transcriptional Activators, Brian Brennan, Zhiqian Wu, Garrette Belanger, Jenifer Lum, Aaron Minter, Steven Rowe, Annette Plachetka, Chinmay Majmudar, Anna Mapp

Brian B. Brennan

The link between a growing number of human diseases and misregulation of gene expression has spurred intense interest in artificial transcriptional activators that could be used to restore controlled expression of affected genes. To expand the repertoire of activation domains available for the construction of artificial transcriptional regulators, a selection strategy was used to identify two unique activation domain motifs. These activation domains bear little sequence homology to endogenous counterparts and bind to unique sites within the transcriptional machinery. A comparison with two well-characterized activation domains, VP2 and P201, demonstrated for the first time that functional potency is not solely …

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High-Field 19.6 T 27Al Solid-State Mas Nmr Of In Vitro Aluminated Brain Tissue, Pamela L. Bryant, Walter J. Lukiw, Zhehong Gan, Randall W. Hall, Leslie G. Butler Sep 2003

High-Field 19.6 T 27Al Solid-State Mas Nmr Of In Vitro Aluminated Brain Tissue, Pamela L. Bryant, Walter J. Lukiw, Zhehong Gan, Randall W. Hall, Leslie G. Butler

Randall W. Hall

The combination of 27Al high-field solid-state NMR (19.6 T) with rapid spinning speeds (17.8 kHz) is used to acquire 27Al NMR spectra of total RNA human brain temporal lobe tissues exposed to 0.10 mM Al3+ (as AlCl3) and of human retinal pigment epithelial cells (ARPE-19), grown in 0.10 mM AlCl3. The spectra of these model systems show multiple Al3+ binding sites, good signal/noise ratios and apparent chemical shift dispersions. A single broad peak (−3 to 11 ppm) is seen for the aluminated ARPE-19 cells, consistent with reported solution-state NMR chemical shifts of Al-transferrin. The aluminated brain tissue has a considerably …

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Reductivedesorption Of 11-Mercaptoundecanoic Acid Monolayers Modified By Covalent Attachment Of 1,3- And 1,4-Phenylenediamine, Mark Anderson, Richard Baltzersen Jul 2003

Reductivedesorption Of 11-Mercaptoundecanoic Acid Monolayers Modified By Covalent Attachment Of 1,3- And 1,4-Phenylenediamine, Mark Anderson, Richard Baltzersen

Mark R. Anderson

1,3- and 1,4-phenylenediamine were covalently attached to a self-assembled monolayer of 11-mercaptoundecanoic acid by formation of an amide bond. Bonding of the phenylenediamine isomers was confirmed by the presence of infrared features attributable to ring vibrational modes, the amide I vibration, and the amide II vibration in the reflection–absorption infrared spectrum of the modified interface. Reductivedesorption peak potentials were shifted by 120 mV for the monolayer modified by 1,4-phenylenediamine and by 90 mV for the monolayer modified by 1,3-phenylenediamine relative to the desorption potential of the unmodified 11-mercaptoundecanoic acid monolayer. These potential shifts represent 23 and 17 kJ/mol stabilization of …

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Three-Dimensional Quantitative Structure−Property Relationship (3d-Qspr) Models For Prediction Of Thermodynamic Properties Of Polychlorinated Biphenyls (Pcbs): Enthalpies Of Fusion And Their Application To Estimates Of Enthalpies Of Sublimation And Aqueous Solubilities, Swati Puri, James S. Chickos, William J. Welsh Apr 2003

Three-Dimensional Quantitative Structure−Property Relationship (3d-Qspr) Models For Prediction Of Thermodynamic Properties Of Polychlorinated Biphenyls (Pcbs): Enthalpies Of Fusion And Their Application To Estimates Of Enthalpies Of Sublimation And Aqueous Solubilities, Swati Puri, James S. Chickos, William J. Welsh

James Chickos

No abstract provided.

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Electrochemical Detection Of Oxidative Stress, Alice Harper, Mark Anderson Mar 2003

Electrochemical Detection Of Oxidative Stress, Alice Harper, Mark Anderson

Mark R. Anderson

No abstract is currently available.

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Studies Of Monolayer Films As Adhesion Promoters, Huimin Li, Mark Anderson Mar 2003

Studies Of Monolayer Films As Adhesion Promoters, Huimin Li, Mark Anderson

Mark R. Anderson

No abstract is currently available.

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Capillary Electrophoresis To Determine Oxidative Stress, Stephanie Hooper, Mark Anderson Mar 2003

Capillary Electrophoresis To Determine Oxidative Stress, Stephanie Hooper, Mark Anderson

Mark R. Anderson

No abstract is currently available.

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Raman Spectroscopy Of Rhombohedral P4o10, Sean J. Gilliam, Scott Kirkby, Clifton N. Merrow, Daniel Zeroka, Ajit Banerjee, James O. Jensen Mar 2003

Raman Spectroscopy Of Rhombohedral P4o10, Sean J. Gilliam, Scott Kirkby, Clifton N. Merrow, Daniel Zeroka, Ajit Banerjee, James O. Jensen

Scott J. Kirkby

A complete Raman vibrational analysis has been performed on phase-pure rhombohedral phosphorus pentoxide (P4O10) at room temperature. The “molecular” Td symmetry is reduced to C3v symmetry when bound in the rhombohedral crystalline lattice. Therefore, the 15 fundamental modes of vibration irreducibly represented as Γvib = 3A1 + 3E + 3T1 + 6T2 reduce to 21 fundamental modes with a factor group analysis resulting in Γvib = 9A1 + 12E for the irreducible representation, all of which are Raman active. Complete vibrational assignments and relative intensities, including all T2 to E and A1 splittings, are reported. Five new E fundamentals (262, …

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Heat Capacities Of Thiane Sulfones And Thiane Sulfoxide: Refining Of Cp Group Values For Organosulfur Compounds And Their Oxides, Marı́A Victoria Roux, Manuel Temprado, Pilar Jiménez, Ramón Guzmán-Mejı́A, Eusebio Juaristi, James S. Chickos Jan 2003

Heat Capacities Of Thiane Sulfones And Thiane Sulfoxide: Refining Of Cp Group Values For Organosulfur Compounds And Their Oxides, Marı́A Victoria Roux, Manuel Temprado, Pilar Jiménez, Ramón Guzmán-Mejı́A, Eusebio Juaristi, James S. Chickos

James Chickos

No abstract provided.

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Enthalpies Of Vaporization Of Organic And Organometallic Compounds, 1880-2002, James S. Chickos, William E. Acree Jan 2003

Enthalpies Of Vaporization Of Organic And Organometallic Compounds, 1880-2002, James S. Chickos, William E. Acree

James Chickos

No abstract provided.

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A Solvent-Free Claisen Condensation Reaction For The Organic Laboratory, John Esteb, Matthew Stockton Dec 2002

A Solvent-Free Claisen Condensation Reaction For The Organic Laboratory, John Esteb, Matthew Stockton

John Esteb

An experiment involving the Claisen condensation reaction for a first-year organic chemistry laboratory is presented. Claisen condensations are routinely covered in organic textbooks but owing to the long reaction times required to reach equilibrium in solution they are seldom explored in the undergraduate teaching laboratory. In this experiment, potassium tert-butoxide and ethyl phenylacetate are heated to 100 °C for 30 minutes under solvent-free conditions to produce 2,4-diphenyl acetoacetate in 80% yield. The solvent-free nature of this procedure greatly reduces the quantity of waste generated by students relative to typical carbonyl condensation experiments.

Note:Link is to the article in a …

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A Solvent-Free Oxidation Of Alcohols In An Organic Laboratory, John Esteb, Michael Schelle, Anne Wilson Dec 2002

A Solvent-Free Oxidation Of Alcohols In An Organic Laboratory, John Esteb, Michael Schelle, Anne Wilson

John Esteb

An oxidation experiment for a first-year organic chemistry class is presented. This oxidation utilizes a solid mixture of CuSO4•5H2O and KMnO4 prepared by mortar and pestle. The oxidations take place under solvent-free conditions and near quantitative yields are obtained for the reactions. Thin-layer chromatography is used to monitor the progress of the reaction. This experiment provides for the simple oxidation of a secondary alcohol to a ketone using a relatively nontoxic oxidizing agent under solvent-free conditions.

Note:Link is to the article in a subscription database available to users affiliated with Butler University. Appropriate login information will be required for …

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Bismuth Compounds In Organic Synthesis. Synthesis Of Resorcinarenes Using Bismuth Triflate, Ram S. Mohan, Katherine E. Peterson, Russell C. Smith Dec 2002

Bismuth Compounds In Organic Synthesis. Synthesis Of Resorcinarenes Using Bismuth Triflate, Ram S. Mohan, Katherine E. Peterson, Russell C. Smith

Ram S. Mohan

Bismuth triflate (5 mol%) smoothly catalyzes the condensation of aromatic and aliphatic aldehydes with resorcinol to give tetrameric cyclic products, resorcinarenes. With benzaldehyde, the product is obtained as a mixture of two diastereomers and the ratio of the diastereomers depends on reaction time. On the other hand, a single diastereomer is obtained with aliphatic aldehydes. The low toxicity and ease of handling of bismuth compounds coupled with fast reaction times make this method an attractive alternative to the existing methods for resorcinarene formation

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Bismuth Compounds In Organic Synthesis. Deprotection Of Ketoximes Using Bismuth Bromide-Bismuth Triflate, Ram S. Mohan, Joshua N. Arnold, Patrick D. Hayes, Robert L. Kohaus Dec 2002

Bismuth Compounds In Organic Synthesis. Deprotection Of Ketoximes Using Bismuth Bromide-Bismuth Triflate, Ram S. Mohan, Joshua N. Arnold, Patrick D. Hayes, Robert L. Kohaus

Ram S. Mohan

Ketoximes undergo deprotection in CH3CN/acetone/H2O (3:6:1) in the presence of 20–40 mol% BiBr3/5 mol% Bi(OTf)3. Bismuth(III) salts are relatively non-toxic, insensitive to air and inexpensive. These features coupled with the use of a relatively non-toxic solvent system make this method an attractive alternative to existing routes for deprotection of ketoximes.

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Reactions Of Boranes And Metallaboranes With Phosphines, Lawrence Barton, Oleg Volkov, Mitsuhiro Hata, Paul Mcquade, Nigam P. Rath Dec 2002

Reactions Of Boranes And Metallaboranes With Phosphines, Lawrence Barton, Oleg Volkov, Mitsuhiro Hata, Paul Mcquade, Nigam P. Rath

Nigam Rath

This paper reports extensions of the well-established field of phosphine–borane chemistry. Linked clusters, for example, {[(PPh3)2(CO)OsB4H7-3-BH2-PPh2]2 [(Fe(C5H4)2]}, are formed in reactions of rigid backboned bidentate phosphines with {2,2,2-(PPh3)2(CO)-nido-2-OsB5H9]. Reaction of bidentate phosphines with the unsaturated clusters [8,8-PPh3)2-nido-8,7-RhSB9H10] and [9,9-(PPh3)2-nido-9,7,8-RhC2B8 H11] leads to the isolation of novel species such as {1-(PPh3)[1,3-(µ-dppm)]-closo -1,2-RhSB9H8},with a dppm molecule bridging adjacent metal and boron vertices in the cage, [1,1-(ç2-dppe)-3-(ç1-dppm)-closo-1,2-RhSB 9H8], a mixed ligand system, and {9,9-ç2-[(ç2-BH3)PPh2PCH2 PPh2]-nido- 9,7,8-RhC2B8H11} which contains a bidentate dppm BH3 moiety. The formation of bidentate phosphine-linked main group transition-metal moieties such as [BH3PPh2(CH)nPPh2IrCp*Cl2] is also described as is an example of …

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