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1-Benzyl-3,5-bis(4-chlorobenzylidene)-piperidin-4-one (open access)

1-Benzyl-3,5-bis(4-chlorobenzylidene)-piperidin-4-one

The title compound, C₂₆H₂₁Cl₂NO, crystallizes with two symmetry-independent molecules in the asymmetric unit.
Date: May 16, 2011
Creator: Nesterov, Volodymyr V.; Sarkisov, Sergey S.; Shulaev, Vladimir & Nesterov, Vladimir N.
Object Type: Article
System: The UNT Digital Library
3,5-Bis(4-chlorobenzylidene)-1-methyl-piperidin-4-one (open access)

3,5-Bis(4-chlorobenzylidene)-1-methyl-piperidin-4-one

In the title molecule, C₂₀H₁₇Cl₂NO, the central heterocyclic ring adopts a flattened boat conformation.
Date: February 23, 2011
Creator: Nesterov, Volodymyr V.; Sarkisov, Sergey S.; Shulaev, Vladimir & Nesterov, Vladimir N.
Object Type: Article
System: The UNT Digital Library
3-Center-4-Electron Bonding in [(silox)2Mo=NtBu]2(μ-Hg) Controls Reactivity while Frontier Orbitals Permit a Dimolybdenum π-Bond Energy Estimate (open access)

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

Article describing research on 3-center-4-electron bonding in [(silox)2Mo=NtBu]2(mu-Hg).
Date: May 18, 2005
Creator: Rosenfeld, Devon C.; Wolczanski, Peter T.; Barakat, Khaldoon A.; Buda, Corneliu & Cundari, Thomas R., 1964-
Object Type: Article
System: The UNT Digital Library
(4+2)-Cycloaddition Reactions of Ketenes; Pyranones (open access)

(4+2)-Cycloaddition Reactions of Ketenes; Pyranones

This study deals with the (4+2)-cycloaddition reactions of 4-π electron compounds with ketenes. Chloroketenes were generated in situ from the corresponding chlorinated acid chlorides in the presence of the ketenophiles. Chloro-, dichloro- and diphenylketenes reacted with 1-methoxy-3-trimethylsiloxy-l,3-butadiene, and 2,4-bis(trimethylsiloxy)-1,3-pentadiene to yield the corresponding dihydropyrans. The dihydropyrans yielded substituted 4-pyranones on hydrolysis.
Date: August 1983
Creator: Agho, Michael O. (Michael Osarenogowu)
Object Type: Thesis or Dissertation
System: The UNT Digital Library
[5,10,15,20-Tetrakis (4-methoxyphenyl)-porphyrinato] zinc dichloromethane disolvate (open access)

[5,10,15,20-Tetrakis (4-methoxyphenyl)-porphyrinato] zinc dichloromethane disolvate

Article on 5,10,15,20-tetrakis(4-methoxyphenyl)-porphyrinato] zinc dichloromethane disolvate.
Date: July 24, 2013
Creator: McGill, Sean; Nesterov, Vladimir N. & Gould, Stephanie L.
Object Type: Article
System: The UNT Digital Library
[5,10,15,20-Tetrakis(4-tolyl)porphyrin]-zinc(II) dichloromethane solvate (open access)

[5,10,15,20-Tetrakis(4-tolyl)porphyrin]-zinc(II) dichloromethane solvate

In the title complex, [Zn(C₄₈H₃₆N₄)]·CH₂Cl₂, the Znᴵᴵ atom lies on an inversion center and the dichloromethane solvent molecule is disordered around an inversion center.
Date: May 26, 2010
Creator: McGill, Sean; Nesterov, Vladimir N. & Gould, Stephanie L.
Object Type: Article
System: The UNT Digital Library
5-Cyano-1,3-phenylene diacetate (open access)

5-Cyano-1,3-phenylene diacetate

This article discusses 5-cyano-1,3-phenylene diacetate.
Date: May 24, 2014
Creator: Abbassi, Bahar; Brumfield, Michela; Jones, Lloyd M.; Nesterov, Vladimir N. & Carr, Andrew J.
Object Type: Article
System: The UNT Digital Library
20 Mule Team (open access)

20 Mule Team

This photograph from the front cover of an issue of the Hexagon Journal displays the mock 20 mule team that stands outside of the Rio Tinto Borax Museum in Boron, California. The mule team depicts the original mode used to transport the chemical compound, borax, out of Death Valley between 1883 and 1888. A description of the photograph is shown on page 23 of the journal.
Date: Summer 2015
Creator: Marshall, James L., 1940- & Marshall, Virginia R.
Object Type: Clipping
System: The UNT Digital Library
The 2011 Beta Eta Spring Banquet. Celebration of Rediscovery of the Elements (open access)

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

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.
Date: Summer 2011
Creator: Marshall, James L., 1940-
Object Type: Article
System: The UNT Digital Library
Ab Initio and Kinetic Modeling Studies of Formic Acid Oxidation (open access)

Ab Initio and Kinetic Modeling Studies of Formic Acid Oxidation

Article on ab initio and kinetic modeling studies of formic acid oxidation.
Date: 2015
Creator: Marshall, Paul & Glarborg, Peter
Object Type: Article
System: The UNT Digital Library
Ab Initio Calculations and Kinetic Modeling of Halon and Halon Replacements (open access)

Ab Initio Calculations and Kinetic Modeling of Halon and Halon Replacements

Paper for the 1996 Halon Options Technical Working Conference (HOTWC). This paper discusses ab initio calculations and kinetic modeling of halon and halon replacements.
Date: May 7, 1996
Creator: Paige, Harvey L.; Berry, Rajiv; Schwartz, Martin; Marshall, Paul; Burgess, Donald R.; Zachariah, Michael Russel, 1957- et al.
Object Type: Paper
System: The UNT Digital Library

Ab Initio Calculations and Kinetic Modeling of Thermal Conversion of Methyl Chloride: Implications for Gasification of Biomass

This article investigates the thermal conversion of CH₃Cl.
Date: November 8, 2017
Creator: Singla, Mellika; Rasmussen, Morten Lund; Hashemi, Hamid; Wu, Hao; Glarborg, Peter; Pelucchi, Matteo et al.
Object Type: Article
System: The UNT Digital Library
Ab Initio Calculations for Kinetic Modeling of Halocarbons (open access)

Ab Initio Calculations for Kinetic Modeling of Halocarbons

This book chapter discusses ab initio calculations for kinetic modeling of halocarbons.
Date: 1998
Creator: Berry, Rajiv; Schwartz, Martin & Marshall, Paul
Object Type: Book Chapter
System: The UNT Digital Library
An ab Initio Investigation of Halocarbenes (open access)

An ab Initio Investigation of Halocarbenes

Article on an ab initio investigation of halocarbenes.
Date: September 10, 1999
Creator: Schwartz, Martin & Marshall, Paul
Object Type: Article
System: The UNT Digital Library
Ab Initio Studies of Polarization and Piezoelectricity in Vinylidene Fluoride and BN-Based Polymers (open access)

Ab Initio Studies of Polarization and Piezoelectricity in Vinylidene Fluoride and BN-Based Polymers

Article on ab initio studies of polarization and piezoelectricity in vinylidene fluoride and BN-based polymers.
Date: 2004
Creator: Nakhmanson, Serge M.; Buongiorno Nardelli, Marco & Bernholc, Jerry
Object Type: Article
System: The UNT Digital Library
An ab Initio Study of Sulfinic Acid and Related Species (open access)

An ab Initio Study of Sulfinic Acid and Related Species

Article on an ab initio study of sulfinic acid and related species.
Date: March 1, 1992
Creator: Laakso, Dianna & Marshall, Paul
Object Type: Article
System: The UNT Digital Library
An ab initio study of the ionization of sodium superoxide (open access)

An ab initio study of the ionization of sodium superoxide

Article on an ab initio study of the ionization of sodium superoxide.
Date: November 15, 1991
Creator: Marshall, Paul
Object Type: Article
System: The UNT Digital Library
An ab initio study of the reaction of atomic hydrogen with sulfur dioxide (open access)

An ab initio study of the reaction of atomic hydrogen with sulfur dioxide

Article on an ab initio study of the reaction of atomic hydrogen with sulfur dioxide.
Date: October 1, 1991
Creator: Binns, Derk Douglas & Marshall, Paul
Object Type: Article
System: The UNT Digital Library
Abraham Model Correlations for Describing Solute Transfer into 2-Butoxyethanol from Both Water and the Gas Phase at 298 K (open access)

Abraham Model Correlations for Describing Solute Transfer into 2-Butoxyethanol from Both Water and the Gas Phase at 298 K

Article on Abraham model correlations for describing solute transfer into 2-butoxyethanol from both water and the gas phase at 298 K.
Date: June 3, 2015
Creator: Sedov, Igor A.; Stolov, Mikhail; Hart, Erin; Grover, Damini; Zettl, Heidi; Koshevarova, Victoria et al.
Object Type: Article
System: The UNT Digital Library
Abraham Model Correlations for Estimating Solute Transfer of Neutral Molecules into Anhydrous Acetic Acid from Water and from the Gas Phase (open access)

Abraham Model Correlations for Estimating Solute Transfer of Neutral Molecules into Anhydrous Acetic Acid from Water and from the Gas Phase

Article on Abraham model correlations for estimating solute transfer of neutral molecules into anhydrous acetic acid from water and from the gas phase.
Date: September 1, 2015
Creator: Stovall, Dawn M.; Schmidt, Amber; Dai, Colleen; Zhang, Shoshana; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
Object Type: Article
System: The UNT Digital Library
Abraham model correlations for predicting gas-to-liquid partition coefficients and activity coefficients of organic solutes dissolved in 1-(2-methoxyethyl)-1-methylpyrrolidinium tris(pentafluoroethyl) trifluorophosphate (open access)

Abraham model correlations for predicting gas-to-liquid partition coefficients and activity coefficients of organic solutes dissolved in 1-(2-methoxyethyl)-1-methylpyrrolidinium tris(pentafluoroethyl) trifluorophosphate

Article on Abraham model correlations for predicting gas-to-liquid partition coefficients and activity coefficients of organic solutes.
Date: 2013
Creator: Jiang, Rui; Anderson, Jared L.; Stephens, Timothy W.; Acree, William E. (William Eugene) & Abraham, M. H. (Michael H.)
Object Type: Article
System: The UNT Digital Library
Abraham model correlations for solute partitioning into o-xylene, m-xylene and p-xylene from both water and the gas phase (open access)

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

Article on 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 N. et al.
Object Type: Article
System: The UNT Digital Library
Abraham Model Correlations for Solute Transfer into 2-Ethoxyethanol from Water and from the Gas Phase (open access)

Abraham Model Correlations for Solute Transfer into 2-Ethoxyethanol from Water and from the Gas Phase

Article on Abraham model correlations for solute transfer into 2-ethoxyethanol from water and from the gas phase.
Date: August 1, 2015
Creator: Sedov, Igor A.; Stolov, Mikhail; Hart, Erin; Grover, Damini; Zettl, Heidi; Koshevarova, Victoria et al.
Object Type: Article
System: The UNT Digital Library
Abraham Model Correlations for Transfer of Neutral Molecules and Ions to Sulfolane (open access)

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

Article on Abraham model correlations for the 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 N. et al.
Object Type: Article
System: The UNT Digital Library