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Carbon-Hydrogen Bond Activation, C-N Bond Coupling, and Cycloaddition Reactivity of a Three-Coordinate Nickel Complex Featuring a Terminal Imido Ligand
In this study, we describe reaction chemistry of the first nickel(II) complexes having a terminally bound imido ligand, (dtbpe)Ni=NR (R = 2,6-ⁱPr₂C₆H₃, 2,3,6-Me₃C₆H₂ (Mes), and Ad) with various small unsaturated molecules.
Date:
December 1, 2014
Creator:
Mindiola, Daniel J.; Waterman, Rory; Iluc, Vlad M.; Cundari, Thomas R., 1964- & Hillhouse, Gregory L.
System:
The UNT Digital Library
Variable Pathways for Oxygen Atom Insertion into Metal-Carbon Bonds: The Case of Cp*W(O)₂(CH₂SiMe₃)
Article discussing variable pathways for oxygen atom insertion into metal-carbon bonds and the case of Cp*W(O)2(CH2SiMe3).
Date:
December 24, 2012
Creator:
Mei, Jiajun; Carsch, Kurtis M.; Freitag, Cody R.; Gunnoe, T. Brent & Cundari, Thomas R., 1964-
System:
The UNT Digital Library
Carbon-Oxygen Bond Formation via Organometallic Baeyer-Villiger Transformations: A Computational Study on the Impact of Metal Identity
Article discussing a computational study on the impact of metal identity and carbon-oxygen bond formation via organometallic Baeyer-Villiger transformations.
Date:
December 20, 2011
Creator:
Figg, Travis M.; Webb, Joanna R.; Cundari, Thomas R., 1964- & Gunnoe, T. Brent
System:
The UNT Digital Library
Studies of Low-Coordinate Iron Dinitrogen Complexes
This article discusses low-coordinate iron dinitrogen complexes. Understanding the interaction of N₂ with iron is relevant to the iron catalyst used in the Haber process and to possible roles of the FeMoco active site of nitrogenase.
Date:
December 31, 2005
Creator:
Smith, Jeremy M.; Sadique, Azwana R.; Cundari, Thomas R., 1964-; Rodgers, Kenton R.; Lukat-Rodgers, Gudrun; Lachicotte, Rene J. et al.
System:
The UNT Digital Library
Methane Activation by Group IVB Imido Complexes
Article discussing an ab initio study of methane activation by group IVB imido complexes.
Date:
December 1992
Creator:
Cundari, Thomas R., 1964-
System:
The UNT Digital Library
A Two-Coordinate Nickel Imido Complex That Effects C-H Amination
This article discusses a two-coordinate nickel imido complex that effects C-H amination.
Date:
December 22, 2010
Creator:
Laskowski, Carl A.; Miller, Alexander J.M.; Hillhouse, Gregory L. & Cundari, Thomas R., 1964-
System:
The UNT Digital Library
Comments Concerning "Fluorescent Probe Studies on the Microstructure of Polystyrene-Poly (vinylpyridine) Diblock Copolymer Film"
This article provides comments on "Fluorescent Probe Studies on the Microstructure of Polystyrene-Poly (vinylpyridine) Diblock Copolymer Film," published in 'Macromolecules,' 1992.
Date:
December 1993
Creator:
Acree, William E. (William Eugene); Tucker, Sheryl A. (Sheryl Ann) & Wilkins, Denise C.
System:
The UNT Digital Library
Prediction of drug solubility in ethanol-ethyl acetate mixtures at various temperatures using the Jouyban-Acree model
Article on the prediction of drug solubility in ethanol-ethyl acetate mixtures at various temperatures using the Jouyban-Acree model.
Date:
December 26, 2007
Creator:
Jouyban, Abolghasem & Acree, William E. (William Eugene)
System:
The UNT Digital Library
Comment on "Measurement and correlation of the solubility of p-coumaric acid in nine pure and water + ethanol mixed solvents at temperatures from 293.15 to 333.15 K"
This article provides comments on the article "Measurement and correlation of the solubility of p-coumaric acid in nine pure and water + ethanol mixed solvents at temperatures from 293.15 to 333.15 K" published in the Journal of Chemical and Engineering Data in 2016.
Date:
December 7, 2016
Creator:
Acree, William E. (William Eugene); Barrera, Maribel & Abraham, M. H. (Michael H.)
System:
The UNT Digital Library
Computational studies of the potential energy surface for O(¹D) + H₂S: Characterization of pathways involving H₂SO, HOSH, and H₂OS
Article on computational studies of the potential energy surface for O(¹D) + H₂S and the characterization of pathways involving H₂SO, HOSH, and H₂OS.
Date:
December 1, 1994
Creator:
Goumri, Abdellatif; Rocha, John-David Ray; Laakso, Dianna; Smith, C. E. & Marshall, Paul
System:
The UNT Digital Library
A Computational Investigation of the Molecular Geometry and Rotational Barriers in Ethylmethyl Ether
Article on a computational investigation of the molecular geometry and rotational barriers in ethyl methyl ether.
Date:
December 1, 1993
Creator:
Stanton, C. L.; Marshall, Paul & Schwartz, Martin
System:
The UNT Digital Library
Solubility of Lamotrigine, Diazepam, and Clonazepam in Ethanol + Water Mixtures at 298.15 K
Article on the solubility of lamotrigine, diazepam, and clonazepam in ethanol + water mixtures at 298.15 K.
Date:
December 22, 2008
Creator:
Shayanfar, Ali; Fakhree, Mohammad Amin Abolghassemi; Acree, William E. (William Eugene) & Jouyban, Abolghasem
System:
The UNT Digital Library
Molecularly Imprinted Polymer Based Extended-Gate Field-Effect Transistor Chemosensors for Phenylalanine Enantioselective Sensing
This article discusses the design and synthesis of molecularly imprinted polymers, guided by DFT calculations.
Date:
December 15, 2016
Creator:
Iskierko, Z.; Checinska, A.; Sharma, Piyush S.; Golebiewska, K.; Noworyta, K.; Borowicz, Pawet et al.
System:
The UNT Digital Library
Redox Activation of Alkene Ligands in Platinum Complexes with Non-innocent Ligands
Article discussing the redox activation of alkene ligands in platinum complexes with non-innocent ligands.
Date:
December 19, 2009
Creator:
Boyer, Julie L.; Cundari, Thomas R., 1964-; DeYonker, Nathan J.; Rauchfuss, Thomas B. & Wilson, Scott R.
System:
The UNT Digital Library
Correlation of surface tension of mixed solvents with solvent composition
Article on the correlation of surface tension of mixed solvents with solvent composition.
Date:
December 1, 2004
Creator:
Jouyban, Abolghasem; Fathi-Azarbayjani, Anahita; Barzegar-Jalali, Mohammad & Acree, William E. (William Eugene)
System:
The UNT Digital Library
Enthalpies of combustion of 2-iodosobenzoic acid and 4-nitrosophenol: the dissociation enthalpy of the I-O bond
Article on the enthalpies of combustion of 2-iodosobenzoic acid and 4-nitrosophenol and the dissociation enthalpy of the I-O bond.
Date:
December 1, 1999
Creator:
Silva, Maria D. M. C. Ribeiro da; Matos, M. Agostinha R.; Ferrão, Maria Luísa C. C. H.; Amaral, Luísa M. P. F.; Miranda, Margarida S.; Acree, William E. (William Eugene) et al.
System:
The UNT Digital Library
HTP kinetics studies of the reactions of O(2(3)Pj) atoms with H2 and D2 over wide temperature ranges
Article on HTP kinetics studies of the reaction of O(2(3)Pj) atoms with H2 and D2 over wide temperature ranges.
Date:
December 15, 1987
Creator:
Marshall, Paul & Fontijn, A. (Arthur)
System:
The UNT Digital Library
Enthalpy of Solvation Correlations for Gaseous Solutes Dissolved in Water and in 1-Octanol Based on the Abraham Model
Article on the enthalpy of solvation correlations for gaseous solutes dissolved in water and in 1-octanol based on the Abraham model.
Date:
December 15, 2007
Creator:
Mintz, Christina; Clark, Michael; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
System:
The UNT Digital Library
Characterization of Reaction Pathways on the Potential Energy Surfaces for H + SO2 and HS + O2
Article on the characterization of reaction pathways on the potential energy surfaces for H + SO2 and HS + O2.
Date:
December 7, 1999
Creator:
Goumri, Abdellatif; Rocha, John-David Ray; Laakso, Dianna; Smith, C. E. & Marshall, Paul
System:
The UNT Digital Library
Modified transition state theory and negative apparent activation energies of simple metathesis reactions: Application to the reaction CH₃ + HBr + CH₄ + Br
Article on modified transition state theory and negative apparent activation energies of simple metathesis reactions and application to the reaction CH₃ + HBr + CH₄ + Br.
Date:
December 18, 2006
Creator:
Krasnoperov, Lev N.; Peng, Jingping & Marshall, Paul
System:
The UNT Digital Library
Kinetic studies of the reaction of atomic hydrogen with trifluoroiodomethane
This article discusses kinetic studies of the reaction of atomic hydrogen with trifluoroiodomethane.
Date:
December 4, 1998
Creator:
Yuan, Jessie; Wells, Leah & Marshall, Paul
System:
The UNT Digital Library
Excited State Charge Separation in Solution and in Electropolymerized Films of Terthiophene-Fullerene Dyad and Phenothiazine-Terthiophene-Fullerene Triad
This article reports synthesis, X-ray structure and excited state events occurring in a terthiophene-C₆₀ dyad (TT-C₆₀), and a phenothiazine-terthiophene-C₆₀ triad (PTZ-TT-C₆₀).
Date:
December 23, 2016
Creator:
Bodenstedt, Kurt; Lim, G. N.; Vdouychenko, Mark; Estrada, Tania; Subbaiyan, Navaneetha K.; Nesterov, Vladimir N. et al.
System:
The UNT Digital Library
Toward Greener Carbon Capture Technologies: A Pharmacophore-Based Approach to Predict CO₂ Binding Sites in Proteins
This article describes the extraction of three-dimensional functional group patterns responsible for binding CO₂ from the few protein-CO₂ complexes that have been characterized by X-ray crystallography.
Date:
December 4, 2009
Creator:
Drummond, Michael L.; Wilson, Angela K. & Cundari, Thomas R., 1964-
System:
The UNT Digital Library
Development of Abraham model correlations for solvation characteristics of linear alcohols
This article discusses the development of Abraham model correlations for solvation characteristics of linear alcohols.
Date:
December 15, 2009
Creator:
Sprunger, Laura M.; Achi, Sai S.; Pointer, Racheal; Blake-Taylor, Brooke H.; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
System:
The UNT Digital Library