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  Partner: UNT College of Arts and Sciences
 Department: Chemistry
 Decade: 2000-2009
 Collection: UNT Scholarly Works
Characterization of the sorption of gaseous and organic solutes onto polydimethyl siloxane solid-phase microextraction surfaces using the Abraham model

Characterization of the sorption of gaseous and organic solutes onto polydimethyl siloxane solid-phase microextraction surfaces using the Abraham model

Date: December 21, 2007
Creator: Sprunger, Laura M.; Proctor, Amy; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
Description: Article on the characterization of the sorption of gaseous and organic solutes onto polydimethyl siloxane solid-phase microextraction surfaces using the Abraham model.
Contributing Partner: UNT College of Arts and Sciences
Chemical Toxicity Correlations for Several Fish Species Based on the Abraham Solvation Parameter Model

Chemical Toxicity Correlations for Several Fish Species Based on the Abraham Solvation Parameter Model

Date: September 1, 2005
Creator: Hoover, Kaci R.; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
Description: Article on chemical toxicity correlations for several fish species based on the Abraham solvation parameter model.
Contributing Partner: UNT College of Arts and Sciences
Chemistry Surrounding Monomeric Copper(l) Methyl, Phenyl, Anilido, Ethoxide, and Phenoxide Complexes Supported by N-Heterocyclic Carbene Ligands: Reactivity Consistent with Both Early and Late Transition Metal Systems

Chemistry Surrounding Monomeric Copper(l) Methyl, Phenyl, Anilido, Ethoxide, and Phenoxide Complexes Supported by N-Heterocyclic Carbene Ligands: Reactivity Consistent with Both Early and Late Transition Metal Systems

Date: September 27, 2006
Creator: Goj, Laurel A.; Blue, Elizabeth D.; Delp, Samuel A.; Gunnoe, T. Brent; Cundari, Thomas R., 1964-; Pierpont, Aaron W. et al.
Description: Article on chemistry surrounding monomeric copper(I) methyl, phenyl, anilido, ethoxide, and phenoxide complexes supported by N-heterocyclic carbene ligands.
Contributing Partner: UNT College of Arts and Sciences
Cluster Core-Level Binding-Energy Shifts: The Role of Lattice Strain

Cluster Core-Level Binding-Energy Shifts: The Role of Lattice Strain

Date: July 2004
Creator: Richter, B.; Kuhlenbeck, H.; Freund, H.-J. & Bagus, Paul S.
Description: Article discussing research on cluster core-level binding-energy shifts and the role of lattice strain.
Contributing Partner: UNT College of Arts and Sciences
Cobalt-Dinitrogen Complexes with Weakened N-N Bonds

Cobalt-Dinitrogen Complexes with Weakened N-N Bonds

Date: June 19, 2009
Creator: Ding, Keying; Pierpont, Aaron W.; Brennessel, William W.; Lukat-Rodgers, Gudrun; Rodgers, Kenton R.; Cundari, Thomas R., 1964- et al.
Description: Article discussing research on cobalt-dinitrogen complexes with weakened N-N bonds.
Contributing Partner: UNT College of Arts and Sciences
Coinage Metal-Ethylene Complexes Supported by Tris(pyrazolyl)borates: A Computational Study

Coinage Metal-Ethylene Complexes Supported by Tris(pyrazolyl)borates: A Computational Study

Date: February 18, 2009
Creator: Kazi, Abul B.; Dias, H. V. Rasika; Tekarli, Sammer M.; Morello, Glenn R. & Cundari, Thomas R., 1964-
Description: Article discussing a computational study of coinage metal-ethylene complexes supported by tris(pyrazolyl)borates.
Contributing Partner: UNT College of Arts and Sciences
Combined Experimental and Computational Studies on the Nature of Aromatic C-H Activation by Octahedral Ruthenium(II) Complexes: Evidence for σ-Bond Metathesis from Hammett Studies

Combined Experimental and Computational Studies on the Nature of Aromatic C-H Activation by Octahedral Ruthenium(II) Complexes: Evidence for σ-Bond Metathesis from Hammett Studies

Date: November 27, 2007
Creator: DeYonker, Nathan J.; Foley, Nicholas A.; Cundari, Thomas R., 1964-; Gunnoe, T. Brent & Petersen, Jeffrey L.
Description: Article discussing combined experimental and computational studies on the nature of aromatic C-H activation by octahedral ruthenium(II) complexes of the type TpRu(L)(NCMe)R [Tp = hydridotris(pyrazolyl)borate; R = alkyl or aryl; L = CO or PMe3].
Contributing Partner: UNT College of Arts and Sciences
Combined Experimental and Computational Study of TpRu{P(pyr)3} (NCMe)Me (pyr = N-pyrrolyl): Inter- and Intramolecular Activation of C-H Bonds and the Impact of Sterics on Catalytic Hydroarylation of Olefins

Combined Experimental and Computational Study of TpRu{P(pyr)3} (NCMe)Me (pyr = N-pyrrolyl): Inter- and Intramolecular Activation of C-H Bonds and the Impact of Sterics on Catalytic Hydroarylation of Olefins

Date: October 4, 2007
Creator: Foley, Nicholas A.; Lail, Marty; Gunnoe, T. Brent; Cundari, Thomas R., 1964-; Boyle, Paul D. & Petersen, Jeffrey L.
Description: This article discusses a combined experimental and computational study of TpRu{P(pyr)3} (NCMe)Me (pyr = N-pyrrolyl).
Contributing Partner: UNT College of Arts and Sciences
Comment on "Systematic Investigation of the Sorption Properties of Polyurethane Foams for Organic Vapors"

Comment on "Systematic Investigation of the Sorption Properties of Polyurethane Foams for Organic Vapors"

Date: August 4, 2007
Creator: Sprunger, Laura M.; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
Description: This article gives a comment to a previous article entitled "Systematic investigation of the sorption properties of polyurethane foams for organic vapors."
Contributing Partner: UNT College of Arts and Sciences
Comments concerning the 'solubility of buckminsterfullerene in tetrahydrofuran, thiophene, tetrahydrothiophene, 1,2-dichlorobenzene, 1,2,4-trichlorobenzene and n-butylamine'

Comments concerning the 'solubility of buckminsterfullerene in tetrahydrofuran, thiophene, tetrahydrothiophene, 1,2-dichlorobenzene, 1,2,4-trichlorobenzene and n-butylamine'

Date: September 2000
Creator: Acree, William E. (William Eugene)
Description: Article commenting on the 'solubility of buckminsterfullerene in tetrahydrofuran, thiophene, tetrahydrothiophene, 1,2-dichlorobenzene, 1,2,4-trichlorobenzene and n-butylamine.'
Contributing Partner: UNT College of Arts and Sciences
Comments on Solid-Liquid Phase Equilibrium and Phase Diagram for the Ternary o-Nitrobenzoic Acid + m-Nitrobenzoic Acid + Ethanol System

Comments on Solid-Liquid Phase Equilibrium and Phase Diagram for the Ternary o-Nitrobenzoic Acid + m-Nitrobenzoic Acid + Ethanol System

Date: June 5, 2009
Creator: Acree, William E. (William Eugene)
Description: Article commenting on a paper published in 2008 in the Journal of Chemical and Engineering Data discussing solid-liquid phase equilibrium and phase diagram for the ternary o-nitrobenzoic acid + m-nitrobenzoic acid + ethanol system.
Contributing Partner: UNT College of Arts and Sciences
Comments on "Solubility of Ethyl Maltol in Aqueous Ethanol Mixtures" (Liu, B.-S.; Liu, R.-J.; Hu, Y.-Q.; Hu, Q.-F. J. Chem. Eng. Data 2008, 53, 2712-2714)

Comments on "Solubility of Ethyl Maltol in Aqueous Ethanol Mixtures" (Liu, B.-S.; Liu, R.-J.; Hu, Y.-Q.; Hu, Q.-F. J. Chem. Eng. Data 2008, 53, 2712-2714)

Date: February 17, 2009
Creator: Jouyban, Abolghasem & Acree, William E. (William Eugene)
Description: This article provides comments on "Solubility of Ethyl Maltol in Aqueous Ethanol Mixtures," published in 2008 in the 'Journal of Chemical and Engineering Data.'
Contributing Partner: UNT College of Arts and Sciences
Comments on "Solvation Parameters. 2. A Simplified Molecular Topology to Generate Easily Optimized Values"

Comments on "Solvation Parameters. 2. A Simplified Molecular Topology to Generate Easily Optimized Values"

Date: September 8, 2006
Creator: Mintz, Christina; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
Description: This article provides comments on "Solvation Parameters. 2. A Simplified Molecular Topology to Generate Easily Optimized Values," published in the Journal of Chemical Information and Modeling.
Contributing Partner: UNT College of Arts and Sciences
Comments on the paper entitled "Determination of the equilibrium constant for complex formation in a binary mixture of chloroform and triethylamine from viscosity data on the basis of the ideal associated solution model"

Comments on the paper entitled "Determination of the equilibrium constant for complex formation in a binary mixture of chloroform and triethylamine from viscosity data on the basis of the ideal associated solution model"

Date: April 2000
Creator: Acree, William E. (William Eugene)
Description: Article commenting on the paper entitled "Determination of the equilibrium constant for complex formation in a binary mixture of chloroform and triethylamine from viscosity data on the basis of the idea associated solution model"
Contributing Partner: UNT College of Arts and Sciences
Comments on "Thermophysical Properties of para-Anisaldehyde (1) + Chlorobenzene (2) at Temperatures of (303.15, 313.15, and 323.15) K and a Pressure of 0.1 MPa" (Baskaran, R.; Kubendran, T. R. J. Chem. Eng. Data 2008, 53, 978-982)

Comments on "Thermophysical Properties of para-Anisaldehyde (1) + Chlorobenzene (2) at Temperatures of (303.15, 313.15, and 323.15) K and a Pressure of 0.1 MPa" (Baskaran, R.; Kubendran, T. R. J. Chem. Eng. Data 2008, 53, 978-982)

Date: July 19, 2008
Creator: Jouyban, Abolghasem & Acree, William E. (William Eugene)
Description: Comments regarding the article, "Thermochemical properties of para-anisaldehyde (1) + chlorobenzene (2) at temperatures of (303.15, 313.15, and 323.15) K and a pressure of 0.1 MPa," published in 2008 in the Journal of Chemical and Engineering Data.
Contributing Partner: UNT College of Arts and Sciences
Comparative Reactivity of TpRu(L)(NCMe)Ph (L = CO or PMe3): Impact of Ancillary Ligand L on Activation of Carbon-Hydrogen Bonds Including Catalytic Hydroarylation and Hydrovinylation/Oligomerization of Ethylene

Comparative Reactivity of TpRu(L)(NCMe)Ph (L = CO or PMe3): Impact of Ancillary Ligand L on Activation of Carbon-Hydrogen Bonds Including Catalytic Hydroarylation and Hydrovinylation/Oligomerization of Ethylene

Date: May 9, 2007
Creator: Foley, Nicholas A.; Lail, Marty; Lee, John P.; Gunnoe, T. Brent; Cundari, Thomas R., 1964- & Petersen, Jeffrey L.
Description: Article discussing research on the comparative reactivity of TpRu(L)(NCMe)Ph (L = CO or PMe3) and the impact of ancillary ligand L on activation of carbon-hydrogen bonds including catalytic hydroarylation and hyrdovinylation/oligomerization of ethylene.
Contributing Partner: UNT College of Arts and Sciences
Composition of Epoxy Resin, Aliphatic Amine Curing Agent and Halogenated Amine

Composition of Epoxy Resin, Aliphatic Amine Curing Agent and Halogenated Amine

Date: April 12, 2005
Creator: Bilyeu, Bryan; Brostow, Witold, 1934- & Menard, Kevin P.
Description: Patent relating to the composition of epoxy resin, aliphatic amine curing agent and halogenated amine.
Contributing Partner: UNT College of Arts and Sciences
Computational s-Block Thermochemistry with the Correlation Consistent Composite Approach

Computational s-Block Thermochemistry with the Correlation Consistent Composite Approach

Date: October 3, 2007
Creator: DeYonker, Nathan J.; Ho, Dustin S.; Wilson, Angela K. & Cundari, Thomas R., 1964-
Description: Article discussing research on computational s-block thermochemistry with the correlation consistent composite approach, which has been shown to accurately compute gas-phase enthalapies of formation for alkali and alkaline earth metal oxides and hydroxides.
Contributing Partner: UNT College of Arts and Sciences
Computational Studies of the Thermochemistry of the Atmospheric Iodine Reservoirs HOI and IONO₂

Computational Studies of the Thermochemistry of the Atmospheric Iodine Reservoirs HOI and IONO₂

Date: April 26, 2008
Creator: Marshall, Paul
Description: Book chapter discussing computational studies of the thermochemistry of the atmospheric iodine reservoirs HOI and IONO₂.
Contributing Partner: UNT College of Arts and Sciences
A computational study of chlorofluoro-methyl radicals

A computational study of chlorofluoro-methyl radicals

Date: January 8, 2003
Creator: Schwartz, Martin; Peebles, Lynda R.; Berry, Rajiv & Marshall, Paul
Description: Article on a computational study of chlorofluoro-methyl radicals.
Contributing Partner: UNT College of Arts and Sciences
Computational Study of Polarizabilities and Second Hyperpolarizabilities of Inorganic Transition Metal Thiometalates and Metalates in Solution

Computational Study of Polarizabilities and Second Hyperpolarizabilities of Inorganic Transition Metal Thiometalates and Metalates in Solution

Date: March 8, 2000
Creator: Cundari, Thomas R., 1964-; Kurtz, Henry A. & Zhou, Tie
Description: This article discusses a computational study of polarizabilities and second hyperpolarizabilities of inorganic transition metal thiometalates and metalates in solution.
Contributing Partner: UNT College of Arts and Sciences
A computational study of the thermochemistry of bromine- and iodine-containing methanes and methyl radicals

A computational study of the thermochemistry of bromine- and iodine-containing methanes and methyl radicals

Date: June 28, 2005
Creator: Marshall, Paul; Srinivas, G. N. & Schwartz, Martin
Description: Article on a computational study of the thermochemistry of bromine- and iodine-containing methanes and methyl radicals.
Contributing Partner: UNT College of Arts and Sciences
Conductor Structures Including Penetrable Materials

Conductor Structures Including Penetrable Materials

Date: February 24, 2004
Creator: Kelber, Jeffry A.; Lei, Jipu; Magtoto, Noel P. & Rudenja, Sergei
Description: Patent relating to conductors used in electronic components and related fabrication methods, and more particularly to metal conductors for use in electronic components created by deposition of metals and related fabrication methods.
Contributing Partner: UNT College of Arts and Sciences
Conversions of Ruthenium (III) Alkyl Complexes to Ruthenium (II) through Ru-Calkyl Bond Homolysis

Conversions of Ruthenium (III) Alkyl Complexes to Ruthenium (II) through Ru-Calkyl Bond Homolysis

Date: February 12, 2005
Creator: Lail, Marty; Gunnoe, T. Brent; Barakat, Khaldoon A. & Cundari, Thomas R., 1964-
Description: This article discusses conversions of Ruthenium(III) alkyl complexes.
Contributing Partner: UNT College of Arts and Sciences