Search Results - "D'Acchioli, Jason S"

Oxalate-Bridged Dinuclear M2 Units:  Dimers of Dimers, Cyclotetramers, and Extended Sheets (M = Mo, W, Tc, Ru, and Rh) by Bursten, Bruce E, Chisholm, Malcolm H, D'Acchioli, Jason S

“…The electronic structures of D 4 h -M2(O2CH)4 and the oxalate-bridged complexes D 2 h -[(HCO2)3M2]2(μ-O2CCO2) and D 4 h -[(HCO2)2M2]4(μ-O2CCO2)4 have been…”
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Patterned Monolayers of Neutral and Charged Functionalized Manganese Arene Complexes on a Highly Ordered Pyrolytic Graphite Surface by Kim, Sang Bok, Pike, Robert D, D'Acchioli, Jason S, Walder, Brennan J, Carpenter, Gene B, Sweigart, Dwight A

“…Complex patterns: The arene manganese tricarbonyl complexes [Mn(η⁵-2,5-didodecoxy-1,4-semiquinone)(CO)₃] and [Mn(η⁶-1,4-dioctyloxybenzene)(CO)₃] BF₄ form…”
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The Many Ways To Have a Quintuple Bond by Merino, Gabriel, Donald, Kelling J, D'Acchioli, Jason S, Hoffmann, Roald

“…The existence and persistence of five-fold (quintuple) bonding in isomers of model RMMR molecules of quite different geometry are examined theoretically. The…”
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Evidence of Enhanced Conjugation in ortho-Arylene Ethynylenes with Transition Metal Coordination by Ren, Qianwei, Reedy, Cole G, Terrell, Eric A, Wieting, Joshua M, Wagie, Robert W, Asplin, Jake P, Doyle, Leah M, Long, Steven J, Everard, Michael T, Sauer, Jon S, Baumgart, Cassandra E, D’Acchioli, Jason S, Bowling, Nathan P

“…The effective conjugation of ortho and ortho-alt-para-arylene ethynylenes, with appropriately positioned pyridine and pyrazine heterocycles, increases upon…”
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Malcolm H. Chisholm - A Memoir by D'Acchioli, Jason S., Clark, David L., Patmore, Nathan J., Murillo, Carlos A.

“…Comments on Inorganic Chemistry Malcolm H. Chisholm - A Memoir…”
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Cations M2(O2CtBu)4 +, Where M = Mo and W, and MoW(O2CtBu)4 +. Theoretical, Spectroscopic, and Structural Investigations by Chisholm, Malcolm H, D'Acchioli, Jason S, Pate, Brian D, Patmore, Nathan J, Dalal, Naresh S, Zipse, David J

“…With the aid of density function theory, the molecular and electronic structures of the molecules Mo2(O2CMe)4, MoW(O2CMe)4, and W2(O2CMe)4 and their…”
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The Curious Case of the Allyl Ligand: A Study in Applying the 18-Electron Rule by Waldhart, Greyson W., Webster, Albert J., Schreiber, Brittany M., Siedschlag, Randall B., D’Acchioli, Jason S.

“…The 18-electron rule is an incredibly powerful tool for explaining the properties and reactivities of organometallic complexes. With the rule, however, comes…”
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On the Nature of the Formation of [(η5-Ind)Ru(CO)2H]: Evidence of a Water-Gas Shift Reaction Mechanism via Triethylamine Reduction by Badger, Robert C, D’Acchioli, Jason S, Oudenhoven, Tracey A, Walder, Brennan J

“…The formation of [(η5-Ind)Ru(CO)2H] from [(η5-Ind)Ru(CO)3]+ was investigated using both 1H and 2H NMR spectroscopy and GC−mass spectrometry. Both NMR and GC-MS…”
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Chemical, Electrochemical, and Theoretical Investigations of [(Cp)Ru(CO)3]+ and [(Ind)Ru(CO)3] by Badger, Robert C, D’Acchioli, Jason S, Gamoke, Benjamin C, Kim, Sang Bok, Oudenhoven, Tracey A, Sweigart, Dwight A, Tanke, Robin S

“…The complexes [(Cp)Ru(CO)3]+ and [(Ind)Ru(CO)3]+ were subjected to chemical, electrochemical, and spectroelectrochemical investigations in an attempt to gauge…”
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The Physical and Electronic Structure of M2 Quadruply Bonded Complexes: A Density Functional Theory Study by Chisholm, Malcolm H., D’Acchioli, Jason S., Hadad, Christopher M.

“…The electronic structures and the physical properties (vertical excitation energies, vibrational stretching frequencies, and bond lengths) of a variety of M–M…”
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Oxidation states “naturally”: A Natural Bond Orbital method for determining transition metal oxidation states by Webster, Albert J., Mueller, Chelsea M., Foegen, Neil P., Sit, Patrick H.-L., Speetzen, Erin D., Cunningham, Drew W., D’Acchioli, Jason S.

“…A simple method is presented for determining the oxidation states of transition metal centers using Natural Bond Orbital (NBO) theory. We probed both…”
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Models for Deep Hydrodesulfurization of Alkylated Benzothiophenes. Reductive Cleavage of C−S Bonds Mediated by Precoordination of Manganese Tricarbonyl to the Carbocyclic Ring by Li, Huazhi, Yu, Kunquan, Watson, Eric J, Virkaitis, Kurtis L, D'Acchioli, Jason S, Carpenter, Gene B, Sweigart, D. A, Czech, Paul T, Overly, Kenneth R, Coughlin, Fred

“…The reduction of (η6-benzothiophene)Mn(CO)3 + with cobaltocene under CO leads to insertion of the Mn(CO)4 - fragment into the C(aryl)−S bond to afford a…”
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η2-Binding of Styrenes to Pt(PPh3)2. The Effect of Precoordination of Manganese Tricarbonyl Cation to the Aromatic Ring by Zhang, Xiao, Yu, Kunquan, Carpenter, G. B, Sweigart, D. A, Czech, Paul T, D'Acchioli, Jason S

“…The ability of the olefinic CC double bond in styrenes to bind to Pt(PPh3)2 is greatly increased by η6-precoordination of Mn(CO)3 + to the arene ring…”
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Benzoyldicarbonyl(η 5 -indenyl)ruthenium(II) by Oudenhoven, Tracey A., Walder, Brennan J., Golen, James A., Rheingold, Arnold L., D'Acchioli, Jason S.

“…In the title molecule, [Ru(C9H7)(C7H5O)(CO)2], the dihedral angle between the mean plane of the indene ring system and the phenyl ring is…”
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Benzoyl-dicarbon-yl(η-inden-yl)ruthenium(II) by Oudenhoven, Tracey A, Walder, Brennan J, Golen, James A, Rheingold, Arnold L, D'Acchioli, Jason S

“…In the title mol-ecule, [Ru(C(9)H(7))(C(7)H(5)O)(CO)(2)], the dihedral angle between the mean plane of the indene ring system and the phenyl ring is 86.28…”
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Concerning the Electronic Coupling of MoMo Quadruple Bonds Linked by 4,4‘-Azodibenzoate and Comparison with t2g6-Ru(II) Centers by 4,4‘-Azodiphenylcyanamido Ligands by CHISHOLM, Malcolm H., D'ACCHIOLI, Jason S., HADAD, Christopher M., PATMORE, Nathan J.

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Concerning the Electronic Coupling of MoMo Quadruple Bonds Linked by 4,4‘-Azodibenzoate and Comparison with t2g 6-Ru(II) Centers by 4,4‘-Azodiphenylcyanamido Ligands by Chisholm, Malcolm H, D'Acchioli, Jason S, Hadad, Christopher M, Patmore, Nathan J

“…From the reactions between Mo2(O2C t Bu)4 and each of terephthalic acid and 4,4‘-azodibenzoic acid, the compounds [Mo2(O2C t Bu)3]2(μ-O2CC6H4CO2) (1) and…”
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Concerning the Electronic Coupling of MoMo Quadruple Bonds Linked by 4,4‘-Azodibenzoate and Comparison with t 2g 6 -Ru(II) Centers by 4,4‘-Azodiphenylcyanamido Ligands by Chisholm, Malcolm H., D'Acchioli, Jason S., Hadad, Christopher M., Patmore, Nathan J.

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Oxalate-Bridged Dinuclear M 2 Units:  Dimers of Dimers, Cyclotetramers, and Extended Sheets (M = Mo, W, Tc, Ru, and Rh) by Bursten, Bruce E., Chisholm, Malcolm H., D'Acchioli, Jason S.

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Cations M 2 (O 2 C t Bu) 4 + , Where M = Mo and W, and MoW(O 2 C t Bu) 4 + . Theoretical, Spectroscopic, and Structural Investigations by Chisholm, Malcolm H., D'Acchioli, Jason S., Pate, Brian D., Patmore, Nathan J., Dalal, Naresh S., Zipse, David J.

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