Browsing by Author Baldridge, Kim K.

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TitleAuthor(s)Issue Date
 
1,2,3- versus 1,2-Indeno Ring Fusions Influence Structure Property and Chirality of Corannulene Bowls
Journal:Journal of Organic Chemistry
Liu, ShiRoch, Loïc M.Allemann, OliverXu, JunVanthuyne, NicolasBaldridge, Kim K.Siegel, Jay S.
2018
 
Ab initio computational study of environmentally harmful gasoline additives: Methyl tert-butyl ether and analogues
Journal:Journal of Physical Chemistry A
Gregerson, Laura N.Siegel, Jay S.Baldridge, Kim K.
2000
 
Ab Initio Density Functional vs Hartree Fock Predictions for the Structure of [18]Annulene: Evidence for Bond Localization and Diminished Ring Currents in Bicycloannelated [18]Annulenes
Journal:Angewandte Chemie (International Edition in English)
Baldridge, Kim K.Siegel, Jay S.
1997
 
Ab initio quantum chemical computations of substituent effects on triaziridine strain energy and heat of formation
Journal:Physical Chemistry Chemical Physics
Peverati, RobertoSiegel, Jay S.Baldridge, Kim K.
2009
 
Ab Initio Structure/Reactivity Investigations of Illudin-Based Antitumor Agents: A Model for Reaction in vivo
Journal:Helvetica Chimica Acta
Gregerson, Laura N.McMorris, Trevor C.Siegel, Jay S.Baldridge, Kim K.
2003
 
Application of structural principles to the design of triptycene-based molecular gears with parallel axes
Journal:Chimia
Frantz, Derik K.Baldridge, Kim K.Siegel, Jay S.
2009
 
Azaindenocorannulenes: Synthesis, Properties, and Chirality
Journal:Organic Letters
Tian, XiaoqiRoch, Loïc M.Vanthuyne, NicolasXu, JunBaldridge, Kim K.Siegel, Jay S.
2019
 
Balancing Steric and Electronic Factors in Push-Pull Benzenes: An ab Initio Study on the Molecular Structure of 1,3,5-Triamino-2,4,6-trinitrobenzene and Related Compounds
Journal:Journal of the American Chemical Society
Baldridge, Kim K.Siegel, Jay S.
1993
 
Basicity of (2,6-pyridino)paracyclophanes: Lone pair-π, cation-π, and solvation effects
Journal:Angewandte Chemie - International Edition
Baldridge, Kim K.Cozzi, FrancoSiegel, Jay S.
2012
 
Baskets, covered baskets, and basket balls: Corannulene based cyclophanes as fullerene mimics
Proceeding/Conference:Tetrahedron
Jon Seiders, T.Baldridge, Kim K.Siegel, Jay S.
2001
 
Bond Alternation in Triannelated Benzenes: Dissection of Cyclic π from “Mills-Nixon” Effects
Journal:Journal of the American Chemical Society
Baldridge, Kim K.Siegel, Jay S.
1992
 
Bond fixation in a [14]annulene: Synthesis, characterization, and ab initio computations of furan adducts of dimethyldihydropyrene
Journal:Journal of the American Chemical Society
Mitchell, Reginald H.Chen, YongshengIyer, Vivekanantan S.Lau, Danny Y.K.Baldridge, Kim K.Siegel, Jay S.
1996
 
Boronic esters of corannulene: Potential building blocks toward icosahedral supramolecules
Journal:Organic Chemistry Frontiers
Da Ros, SaraLinden, AnthonyBaldridge, Kim K.Siegel, Jay S.
2015
 
C-F activation of fluorobenzene by silylium carboranes: Evidence for incipient phenyl cation reactivity
Journal:Angewandte Chemie - International Edition
Duttwyler, SimonDouvris, ChristosFackler, Nathanael L.P.Tham, Fook S.Reed, Christopher A.Baldridge, Kim K.Siegel, Jay S.
2010
 
Canastanes: Ab initio quantum mechanical prediction of new curved polynuclear aromatic hydrocarbon motif
Journal:Journal of the American Chemical Society
Baldridge, Kim K.Siegel, Jay S.
1999
 
Chiral Atropisomeric Indenocorannulene Bowls: Critique of the Cahn–Ingold–Prelog Conception of Molecular Chirality
Journal:Angewandte Chemie - International Edition
Wang, YujiaAllemann, OliverBalaban, T. SilviuVanthuyne, NicolasLinden, AnthonyBaldridge, Kim K.Siegel, Jay S.
2018
 
Close covalent contacts: Gauging molecular compression in a molecular compression chamber
Journal:Physical Chemistry Chemical Physics
Berstis, LauraSiegel, Jay S.Baldridge, Kim K.
2014
 
Competition between π-arene and lone-pair halogen coordination of silylium ions?
Journal:Journal of the American Chemical Society
Romanato, PaolaDuttwyler, SimonLinden, AnthonyBaldridge, Kim K.Siegel, Jay S.
2011
 
Cooperative Weak Dispersive Interactions Actuate Catalysis in a Shape-Selective Abiological Racemase
Journal:Journal of the American Chemical Society
Wang, YujiaRickhaus, MichelBlacque, OlivierBaldridge, Kim K.Juríček, MichalSiegel, Jay S.
2022
 
Corannulene derivatives as non-fullerene acceptors in solution-processed bulk heterojunction solar cells
Journal:Journal of Materials Chemistry A
Lu, Ru QiangZheng, Yu QingZhou, Yi NyuYan, Xiao YunLei, TingShi, KeZhou, YanPei, JianZoppi, LauraBaldridge, Kim K.Siegel, Jay S.Cao, Xiao Yu
2014
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