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 Language: English
 Collection: UNT Scholarly Works
3-Center-4-Electron Bonding in [(silox)2Mo=NtBu]2(μ-Hg) Controls Reactivity while Frontier Orbitals Permit a Dimolybdenum π-Bond Energy Estimate

3-Center-4-Electron Bonding in [(silox)2Mo=NtBu]2(μ-Hg) Controls Reactivity while Frontier Orbitals Permit a Dimolybdenum π-Bond Energy Estimate

Date: May 18, 2005
Creator: Rosenfeld, Devon C.; Wolczanski, Peter T.; Barakat, Khaldoon A.; Buda, Corneliu & Cundari, Thomas R., 1964-
Description: This article discusses 3-center-4-electron bonding. Abstract: Na/Hg reduction of (silox)2Cl2Mo=NtBu (3) afforded C2h [(silox)2Mo=NtBu]2(μ-Hg) (12-Hg), which consists of two distorted trigonal monoprisms with Hg at the each apex (d(MoHg) = 2.6810(5)Å). Calculations reveal 3c4e bonding in the linear MoHgMo linkage that renders 12-Hg susceptible to nucleophilic cleavage. Exposure to PMe3 and pyridine rapidly (<5 min) affords (silox)2(tBuN)MoLn (L = PMe3, n = 1 (1-PMe3); py, n = 2 (1-py2)), while poorer nucleophiles (L = C2H4, 2-butyne) yield adducts (e.g., 1-C2H4 and 1-C2Me2) after prolonged heating. The HOMO and LUMO of 12-Hg are "stretched" π and π* orbitals from which four states arise: 1Ag (GS), 3Bu, 1Bu, and 1Ag. ∆E = E(1Bu) - E(3Bu) = 2K, where K is the exchange energy. Magnetic studies indicate E(3Bu) - E(1Ag) ≈ 550 cm-1 (calcd 1744 cm-1), and a UV-vis absorption at 10 000 cm-1 is assigned to 1Ag → 1Bu, permitting K to be evaluated as 4725 cm-1. With the π → π* transition in Schrock's [Mo(NAr)(CH2tBu)(OC6F5)]2 (4) assigned at 528 nm, this estimation places its π-bond energy as {E(π2 → π-1 → π*1 in 4) - E(1Ag → 1Bu in 12-Hg)} + E(1Ag → 3Bu in 12-Hg) = 27 kcal/mol.
Contributing Partner: UNT College of Arts and Sciences
7.5 Minute Quadrangle Project

7.5 Minute Quadrangle Project

Date: October 18, 2010
Creator: Phillips, Mark Edward
Description: This presentation discusses the 7.5 minute quadrangle project by the University of North Texas (UNT) Libraries' Digital Projects Unit. This presentation gives the background, goals, processes, challenges, and next steps.
Contributing Partner: UNT Libraries
₁¹H+ - and ₂⁴He+ - induced M-shell x-ray-production cross sections for selected elements in the rare-earth region

₁¹H+ - and ₂⁴He+ - induced M-shell x-ray-production cross sections for selected elements in the rare-earth region

Date: December 1983
Creator: Mehta, R.; Duggan, Jerome L.; Price, J. L.; Kocur, P. M.; McDaniel, Floyd Del. (Floyd Delbert), 1942- & Lapicki, Gregory
Description: This article discusses ₁¹H+ - and ₂⁴He+ -induced M-shell x-ray production cross sections for selected elements in the rare-earth region. Abstract: The measurements of M-shell x-ray-production cross sections induced by ₁¹H+ and ₂⁴He+ ions are compared to the first-Born-approximation and ECPSSR (energy loss, Coulomb-deflection effects; perturbed-stationary-state approximation, with relativistic corrections) theories. Most of the reported experimental data were measured in the authors' laboratory and the other measurements were taken from the literature. The data from the authors' laboratory were for incident H+ and He+ ions in the energy range from 0.25 to 2.5 MeV. The M-shell x-ray-production cross sections were measured for the following thin targets: 59Pr, 60Nd, 63Eu, 64Gd, 66Dy, 67Ho, 68Er, 70Yb, and 72Hf. The data were for the following elements: 54Xe, 59Pr, 60Nd, 62Sm, 63Eu, 64Gd, 65Tb, 66Dy, 67Ho, 68Er, 70Yb, 72Hf, 73Ta, 74W, 78Pt, 79Au, 80Hg, 82Pb, 83Bi, and 92U. The first-born-approximation calculations of the ionization cross section were made using the plane-wave Born approximation for direct ionization and the Oppenheimer-Brinkman-Kramers approximation of Nikolaev for electron capture. The ECPSSR theory of Brandt and Lapicki [Phys. Rev. A 23, 1717 (1981)] goes beyond the first Born approximation and accounts for the energy loss, Coulomb deflection, and relativistic ...
Contributing Partner: UNT College of Arts and Sciences
2008 DOT GOV Harvest Preserving Access

2008 DOT GOV Harvest Preserving Access

Date: October 21, 2008
Creator: Hartman, Cathy Nelson & Phillips, Mark Edward
Description: This presentation outlines the history, tool building, partner activities and future work for a collaborative project between the University of North Texas, the Library of Congress, the Internet Archive, the California Digital Library, and the U.S. Government Printing Office.
Contributing Partner: UNT Libraries
The 2011 Beta Eta Spring Banquet. Celebration of Rediscovery of the Elements

The 2011 Beta Eta Spring Banquet. Celebration of Rediscovery of the Elements

Date: Summer 2011
Creator: Marshall, James L., 1940-
Description: Article describing an Eta Beta celebration of the completion of James and Virginia Marshall's "Rediscovery of the Elements." Photographs from the event are included. Three separate articles appear on the right side of the page.
Contributing Partner: UNT College of Arts and Sciences
2012 Presidential Primaries

2012 Presidential Primaries

Date: April 2012
Creator: Mondragon-Becker, Antonio
Description: This poster introduces the faculty lecture series UNT Speaks Out on the 2012 Presidential Primaries. This series features Dr. Tony Carey, assistant professor in the Department of Political Science, Dr. Matthew Eshbaugh-Soha, associate professor in the Department of Political Science, and Dr. Brian Lain, associate professor in the Department of Communications Studies and director of UNT's Debate Program.
Contributing Partner: UNT Libraries
The 2012 Republican Primaries

The 2012 Republican Primaries

Date: April 24, 2012
Creator: Eshbaugh-Soha, Matthew, 1972-
Description: This presentation is part of the faculty lecture series UNT Speaks Out on the 2012 Presidential Primaries. In this presentation, the author gives the audience an overview of the structure of the primaries, and provides a recap of past primaries. The author also speaks about the money, momentum, and media attention in the primaries.
Contributing Partner: UNT College of Arts and Sciences
The 21st Century Library: Collaborative Services, Standards, and Interoperability

The 21st Century Library: Collaborative Services, Standards, and Interoperability

Date: October 26, 2002
Creator: Moen, William E.
Description: This presentation discusses the collaborative services, standards and interoperability of libraries in the 21st century. The topics include information about the emerging library environment, interoperability, key standards, and designing services for the networked library.
Contributing Partner: UNT College of Information
Abraham model correlations for solute partitioning into o-xylene, m-xylene and p-xylene from both water and the gas phase

Abraham model correlations for solute partitioning into o-xylene, m-xylene and p-xylene from both water and the gas phase

Date: September 2011
Creator: Stephens, Timothy W.; De la Rosa, Nohelli E.; Saifullah, Mariam; Ye, Shulin; Chou, Vicky; Quay, Amanda et al
Description: This article discusses Abraham model correlations for solute partitioning into o-xylene, m-xylene and p-xylene from both water and the gas phase. Abstract: Experimental data have been compiled from the publisher literature on the partition coefficients of solutes and vapors into o-xylene, m-xylene and p-xylene at 298 K. The logarithms of the water-to-xylene partition coefficients, log P, and gas-to-xylene partition coefficients, log K, were correlated with the Abraham solvation parameter model. The derived mathematical expressions described the observed log P and log K data for the three xylene isomers to within average deviations of 0.14 log units or less.
Contributing Partner: UNT College of Arts and Sciences
Abraham Model Correlations for Transfer of Neutral Molecules and Ions to Sulfolane

Abraham Model Correlations for Transfer of Neutral Molecules and Ions to Sulfolane

Date: October 15, 2011
Creator: Stephens, Timothy W.; De la Rosa, Nohelli E.; Saifullah, Mariam; Ye, Shulin; Chou, Vicky; Quay, Amanda et al
Description: This article discusses Abraham model correlations for the transfer of neutral molecules and ions to sulfolane. Data have been compiled from the published literature on the partition coefficients of solutes and vapors into anhydrous sulfolane. The logarithms of the water-to-sulfolane partition coefficients, log P, and gas-to-sulfolane partition coefficients, log K, were correlated with the Abraham solvation parameter model. The derived correlations described the observed log P and log K values for solutes dissolved in sulfolane to within average standard deviations of 0.14 log units or less. The log P correlation was extended to include the partition of ions by inclusion of a cation-solvent and an anion-solvent term.
Contributing Partner: UNT College of Arts and Sciences
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