S. Bachrach

发表

Conformational equilibria in butane-1,4-diol: a benchmark of a prototypical system with strong intramolecular H-bonds.

Jan M. L. Martin, S. Kozuch, S. Bachrach, 2014, The journal of physical chemistry. A.

Computed Spectral Properties and Structure Identification

S. Bachrach, 2014 .

Computational Approaches to Understanding Enzymes

S. Bachrach, 2014 .

Ab Initio Study of the Thio-Ene Reaction. 1. The Enophile Substituent Effect.

Sulin Jiang, S. Bachrach, 1997, The Journal of organic chemistry.

Ab initio investigation of the diels‐alder reaction between 2H‐phosphole and phosphaethene: A model for phosphole dimerization

Debbie C. Mulhearn, U. Salzner, S. Bachrach, 1997 .

Structure, topological electron density analysis and aromaticity of 4‐heterosubstituted methylenecyclopropenes: X XCH2, NH, O, SiH2, PH and S

S. Bachrach, Meixia Liu, 1991 .

Topological electron density analysis of phosphines, phosphaalkenes and phosphaalkynes

S. Bachrach, 1989 .

Nucleophilic substitution at oxygen: the reaction of phosphine and ammonia with ammonia oxide. An ab initio investigation

S. Bachrach, 1990 .

Theoretical studies of nucleophilic substitution at phosphorus. Phosphine + hydride .fwdarw. H- + PH3

Debbie C. Mulhearn, S. Bachrach, 1993 .

Selective Nucleophilic Attack of Trisulfides. An ab Initio Study

Debbie C. Mulhearn, S. Bachrach, D. Mulhearn, 1996 .

Theoretical study of nucleophilic substitution at two-coordinate sulfur.

S. Bachrach, B. D. Gailbreath, 2001, The Journal of organic chemistry.

Effect of ring strain on the thiolate-disulfide exchange. A computational study.

Debbie C. Mulhearn, S. Bachrach, Joshua T Woody, 2002, The Journal of organic chemistry.

Theoretical study of nucleophilic substitution at the disulfide bridge of cyclo-l-cystine.

S. Bachrach, Adam C. Chamberlin, 2003, The Journal of organic chemistry.

Effect of Micro and Bulk Solvation on the Mechanism of Nucleophilic Substitution at Sulfur in Disulfides

S. Bachrach, J. Hayes, 2003 .

Nucleophilic attack at selenium in diselenides and selenosulfides. A computational study

S. Bachrach, D. Demoin, M. Luk, 2004 .

Theoretical study of nucleophilic substitution at sulfur in sulfinyl derivatives.

S. Bachrach, J. Hayes, S. Norton, 2005, The Journal of organic chemistry.

Comprar Computational Organic Chemistry | Steven M. Bachrach | 9780471713425 | Wiley

S. Bachrach, 2007 .

"Planetary Orbit" Systems Composed of Cycloparaphenylenes.

S. Bachrach, Zeina-Christina Zayat, 2016, The Journal of organic chemistry.

The crystal structure of UO2Cl2(OH2)(MeCN)2·2MeCN

R. Rogers, S. Bachrach, C. Mertz, 1989 .

Mechanism of thiolate-disulfide exchange: addition-elimination or effectively S(N)2? Effect of a shallow intermediate in gas-phase direct dynamics simulations.

M. Siebert, W. Hase, S. Bachrach, 2012, The journal of physical chemistry. A.

Cycloparaphenylene Lemniscates and Trefoils.

S. Bachrach, 2019, The Journal of organic chemistry.

Electron density superposition errors in ethynyllithium

A. Streitwieser, S. Bachrach, 1984 .

Microsolvation of glycine: a DFT study.

S. Bachrach, 2008, The journal of physical chemistry. A.

DFT study of the ExBox·aromatic hydrocarbon host-guest complex.

S. Bachrach, 2013, The journal of physical chemistry. A.

Ab initio calculations on the diazirinyl anion. A nonaromatic species

R. Kroeker, S. Bachrach, S. Kass, 1991 .

Ring strain energies of tetraphospha- and tetraarsacubanes

S. Bachrach, B. D. Gailbreath, 1998 .

The gem-dimethyl effect revisited.

S. Bachrach, 2008, The Journal of organic chemistry.

Computational studies of ethynyl- and diethynyl-expanded tetrahedranes, prismanes, cubanes, and adamantanes.

S. Bachrach, D. Demoin, 2006, The Journal of organic chemistry.

Structure, Deprotonation Energy, and Cation Affinity of an Ethynyl-Expanded Cubane

S. Bachrach, 2003 .

Microsolvation of 1,4-butanediol: the competition between intra- and intermolecular hydrogen bonding.

S. Bachrach, 2014, The journal of physical chemistry. A.

Competing elimination and substitution reactions of simple acyclic disulfides.

S. Bachrach, A. Pereverzev, 2005, Organic & biomolecular chemistry.

Designing a "Flatter" ExBox(4+) Analogue.

S. Bachrach, Zachary O M Nickle, 2015, The journal of physical chemistry. A.

Extended hydrogen bond network enabled superbases.

S. Bachrach, 2012, Organic letters.

STRUCTURE AND BONDING IN DILITHIOMETHANE

A. Streitwieser, S. Bachrach, 1984 .

Cycloaddition reactions between 2 H-phosphole and phosphaketene: Ab initio examination of [2 + 2] and [4 + 2] pathways

U. Salzner, S. Bachrach, 1997 .

Diels-Alder reactions of aza- and phospha-1,3-butadienes with ethylene. An ab initio study

S. Bachrach, Meixia Liu, 1992 .

Organic Reactions of Anions

S. Bachrach, 2014 .

Ab initio study of the Diels–Alder reactions of prop-2-enethial

Sulin Jiang, S. Bachrach, 1998 .

Fundamentals of Organic Chemistry

S. Bachrach, 2014 .

Aromaticity of annulated benzene, pyridine and phosphabenzene

S. Bachrach, 2002 .

THE DIELS-ALDER REACTION OF 1,3,5-TRIPHOSPHABENZENE WITH PHOSPHAACETYLENE

S. Bachrach, P. Magdalinos, 1996 .

Organic Reaction Dynamics

S. Bachrach, 2014 .

Bond paths and bond properties of carbon-lithium bonds

S. Bachrach, J. P. Ritchie, 1987 .

Population Analysis and Electron Densities from Quantum Mechanics

Steven M. Bachrach, S. Bachrach, 2007 .

Tetrasubstituted bisadamantylidenes—Highly twisted alkenes

S. Bachrach, 2018 .

Alkali Metal Salts of Dianions: A Theoretical and Experimental Study of (C6H4)2-M+ (M = Li and Na)

S. Bachrach, S. Kass, M. Hare, 1998 .

Tetraphenylene ring flip revisited.

S. Bachrach, 2009, The Journal of organic chemistry.

Computational Studies of [2+2] and [4+2] Pericyclic Reactions between Phosphinoboranes and Alkenes. Steric and Electronic Effects in Identifying a Reactive Phosphinoborane that Should Avoid Dimerization

S. Bachrach, A. T. Gilbert, 2007 .

Chiral Superbases with Extended Hydrogen Bond Networks.

S. Bachrach, 2019, The Journal of organic chemistry.

Conformations and relative energies of tetrahydropyridines

S. Bachrach, Meixia Liu, 1992 .

Electron density analysis of the reaction of aldehydes with lithium hydride. The general importance of the HOMO-HOMO interaction

A. Streitwieser, S. Bachrach, 1986 .

Theoretical Study of the Diels-Alder Reaction of Selenoaldehydes and Selenoketones.

Sulin Jiang, S. Bachrach, 1999, The Journal of organic chemistry.

PREPARATION OF 1,3-DIPHOSHAALLENE FROM 1,2-DIPHOSPHACYCLOPROPANES: A THEORETICAL INVESTIGATION

S. Bachrach, Meixia Liu, 1990 .

Quantum Mechanics for Organic Chemistry

S. Bachrach, 2014 .

Cycloparaphenylene Möbius trefoils.

H. Rzepa, S. Bachrach, 2020, Chemical communications.

DFT study of [2.2]-, [3.3]-, and [4.4]paracyclophanes: strain energy, conformations, and rotational barriers.

S. Bachrach, 2011, The journal of physical chemistry. A.

Theoretical studies of phosphirane and phosphetane

S. Bachrach, 1989 .

Solution‐Phase Organic Chemistry

S. Bachrach, 2014 .

1,3-Diphosphabicyclo[1.1.1]pentane dication: theoretical evidence for an inverted phosphorus atom

S. Bachrach, 1990 .

Diradicals and Carbenes

S. Bachrach, 2014 .

Theoretical investigation of the conversion of methylene-1,2-diphosphirane carbene to 1,4-diphospha-1,2,3-butatriene

S. Bachrach, 1992 .

Microsolvation of uracil and its conjugate bases: a DFT study of the role of solvation on acidity.

S. Bachrach, M. Dzierlenga, 2011, The journal of physical chemistry. A.

Amine superbases stabilized by extended hydrogen bond networks.

S. Bachrach, 2013, The Journal of organic chemistry.

The quest for a triplet ground‐state alkene: Highly twisted C═C double bonds

D. Lenoir, S. Bachrach, J. Wu, 2019, Journal of Physical Organic Chemistry.

Application of an approximate double substitution coupled cluster (ACCD) method to the potential curves of CO and NeHe: Higher order correlation effects in chemically and weakly bonded molecules

Steven M. Bachrach, Clifford E. Dykstra, C. E. Dykstra, 1981 .

Proton affinity of SO3

L. Sunderlin, S. Bachrach, C. A. Pommerening, 1999 .

Addition of Protonated Water to SO3

L. Sunderlin, S. Bachrach, C. A. Pommerening, 1999 .

The Gas-Phase Basicity of Sulfuric Acid

L. Sunderlin, S. Bachrach, Khanh Do, 1998 .

Diels-Alder Reaction of Furan with Cyclopropenone. An ab Initio Study

S. Bachrach, 1995 .

Towards assessing the aromaticity of the Diels–Alder transition state

S. Bachrach, Paul B. White, 2007 .

Amide coordination effects in organolithiums

S. Bachrach, J. P. Ritchie, 1989 .

Some methods and applications of electron density distribution analysis

Steven M. Bachrach, James P. Ritchie, S. Bachrach, 1987 .

Who Should Own Scientific Papers?

P. Ginsparg, A. Moffat, N. Kestner, 1998, Science.

Using the pyridine and quinuclidine scaffolds for superbases: a DFT study.

S. Bachrach, Cecily C. Wilbanks, 2010, The Journal of organic chemistry.

Ab initio study of the reaction of silene with formaldehyde

A. Streitwieser, S. Bachrach, 1985 .

Cyclooctatetraenophanes: A Computational Study.

S. Bachrach, M. Tang, 2015, The Journal of organic chemistry.

Topological electron density analysis of halogen-substituted phosphirenes

S. Bachrach, 1992 .

Application of various population methods to some oxygenated compounds

A. Streitwieser, S. Bachrach, 1989 .

The group equivalent reaction: An improved method for determining ring strain energy

Steven M. Bachrach, S. Bachrach, 1990 .

Computational Organic Chemistry: Bachrach/Computational Organic Chemistry

S. Bachrach, 2014 .

DFT study of cycloparaphenylenes and heteroatom-substituted nanohoops.

S. Bachrach, D. Stück, 2010, The Journal of organic chemistry.

Planar rings in nano-Saturns and related complexes.

S. Bachrach, 2019, Chemical communications.

All-carbon, neutral analogue of ExBox4+: A DFT study of polycyclic aromatic hydrocarbon binding.

S. Bachrach, A. E. Andrews, 2014, The journal of physical chemistry. A.

Chemistry on the Internet: The Northern Illinois University Chemistry WWW/Gopher Site

S. Bachrach, 1995 .

AB INITIO STUDIES OF THE DIMERIZATION OF KETENE AND PHOSPHAKETENE

U. Salzner, S. Bachrach, 1994 .

Theoretical exammation of the Diels–Alder reaction of 1,3-butadiene with cyclopentadiene and 2H-phosphole

S. Bachrach, L. Perriott, 1996 .

[1,3]-Sigmatropic rearrangement of 1,3,5-triphosphabicyclo[2.1.0]pent-2-ene

J. F. Nixon, S. Bachrach, Vinicius Caliman, 1995 .

The reaction of cyclopentyne with ethene: concerted vs stepwise mechanism?

S. Bachrach, J. Gilbert, 2004, The Journal of organic chemistry.

DFT study of the cycloaddition reactions of strained alkynes.

D. Laird, S. Bachrach, J. Gilbert, 2001, Journal of the American Chemical Society.

Molecular structure of phosphonium ylides

S. Bachrach, 1992 .

Challenges in computational organic chemistry

Steven M. Bachrach, S. Bachrach, 2014 .

InChI: a user’s perspective

Steven M. Bachrach, S. Bachrach, 2012, Journal of Cheminformatics.

Chemistry publication – making the revolution

Steven M. Bachrach, S. Bachrach, 2009, J. Cheminformatics.

TOPOLOGICAL ELECTRON DENSITY ANALYSIS OF ORGANOSULFUR COMPOUNDS

U. Salzner, S. Bachrach, 1995 .

The Topology of Molecules with Twelve Fused Phenyl Rings ([12]Circulenes): Rings, Infinitenes, and Möbius Infinitenes.

S. Bachrach, 2023, The Journal of organic chemistry.

The resonance energy of methylenecyclopropene and cyclopropenone

S. Bachrach, 1990 .

SPARC: The view from the faculty

Steven Bachrach, S. Bachrach, 2001 .

Potential Energy Surface of SOCl3

L. Sunderlin, S. Bachrach, J. Hayes, 2001 .

Computational Organic Chemistry: Bachrach/Computational Organic Chemistry

S. Bachrach, 2014 .

Diels−Alder Reaction of an Ene−Phospha−Yne

S. Bachrach, 1997 .

Effect of ring strain on nucleophilic substitution at selenium: a computational study of cyclic diselenides and selenenyl sulfides.

S. Bachrach, C. Walker, F. Lee, 2007, The Journal of organic chemistry.