UB Paderborn / Katalog / Suche / in CDI

Sortiert nach

Einfacher Volltextzugriff von (fast) überall

Installieren Sie die LibKey Nomad-Browsererweiterung und erhalten Sie von vielen Webseiten einfachen Zugriff auf lizenzierte Volltexte oder Open Access Publikationen. Mehr erfahren...

Design and impact of a stoichiometry voluntary online course for entering first-year STEM college students

Chemistry Education Research and Practice, 2024-01, Vol.25 (1), p.11-24

2024

Volltextzugriff (PDF)

A DFT Study of the Regioselectivity in Intramolecular Diels-Alder Reactions with Formation of a Tricyclodecane Skeleton

Letters in organic chemistry, 2011-02, Vol.8 (2), p.125-131

2011

Volltextzugriff (PDF)

Lewis Molecular Acidity of Ionic Liquids from Empirical Energy–Density Models

The journal of physical chemistry. B, 2013-02, Vol.117 (6), p.1911-1920

2013

Volltextzugriff (PDF)

BACK TO BASICS: MODERN REACTIVITY CONCEPTS WITHIN THE HMO THEORY FRAMEWORK è

Journal of the Chilean Chemical Society, 2004-06, Vol.49 (2), p.107-111

2004

Volltextzugriff (PDF)

An Aromaticity Scale Based on the Topological Analysis of the Electron Localization Function Including σ and π Contributions

Journal of chemical theory and computation, 2005-01, Vol.1 (1), p.83-86

2005

Volltextzugriff (PDF)

Group electrophilicity as a model of nucleofugality in nucleophilic substitution reactions

Chemical physics letters, 2006-05, Vol.422 (4), p.340-344

2006

Volltextzugriff (PDF)

Electrophilicity of quinones and its relationship with hydride affinity

Chemical physics letters, 2009-03, Vol.471 (1), p.168-173

2009

Volltextzugriff (PDF)

Invariance of electrophilicity of independent fragments. Application to intramolecular Diels–Alder reactions

Chemical physics letters, 2010-10, Vol.499 (4), p.272-277

2010

Volltextzugriff (PDF)

On the catalytic effect of water in the intramolecular Diels–Alder reaction of quinone systems: a theoretical study

Molecules (Basel, Switzerland), 2012-11, Vol.17 (11), p.13687-13703

2012

Volltextzugriff (PDF)

Bond Fukui Functions As Descriptor of the Electron Density Reorganization in π Conjugated Systems

Journal of organic chemistry, 2012-01, Vol.77 (1), p.90-95

2012

Volltextzugriff (PDF)

Broken symmetry analysis of spin coupling in iron-sulfur clusters

Journal of the American Chemical Society, 1988-02, Vol.110 (4), p.1001-1005

1988

Volltextzugriff (PDF)

Comparison between Experimental and Theoretical Scales of Electrophilicity in Benzhydryl Cations

Journal of organic chemistry, 2002-07, Vol.67 (14), p.4747-4752

2002

Volltextzugriff (PDF)

A Theoretical Study on the Reaction Mechanism for the Bergman Cyclization from the Perspective of the Electron Localization Function and Catastrophe Theory

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2005-04, Vol.109 (16), p.3687-3693

2005

Volltextzugriff (PDF)

Permanent group effect on nucleofugality in aryl benzoates

Chemical physics letters, 2010-09, Vol.498 (1), p.221-225

2010

Volltextzugriff (PDF)

Empirical scale of nucleophilicity for substituted pyridines

Chemical physics letters, 2006-04, Vol.422 (1), p.204-209

2006

Volltextzugriff (PDF)

Nucleofugality index in α-elimination reactions

Chemical physics letters, 2007-05, Vol.439 (1), p.177-182

2007

Volltextzugriff (PDF)

Substituent effects in the mechanism of mono-substituted acetylene trimerization: A topological analysis of the electron localization function

Chemical physics letters, 2009-02, Vol.469 (1-3), p.219-223

2009

Volltextzugriff (PDF)

Proton transport catalysis in intramolecular rearrangements: A density functional theory study

Chemical physics letters, 2008-10, Vol.464 (4), p.271-275

2008

Volltextzugriff (PDF)

Comparison between Experimental and Theoretical Scales of Electrophilicity Based on Reactivity Indexes

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2002-04, Vol.106 (15), p.3964-3966

2002

Volltextzugriff (PDF)

Two state reactivity mechanism for the rearrangement of hydrogen peroxynitrite to nitric acid

Chemical physics letters, 2008-05, Vol.457 (1), p.216-221

2008

Volltextzugriff (PDF)

Molecular modelling of lithium intercalation in 1T-TiS2

Journal of physics. Condensed matter, 1997-04, Vol.9 (14), p.3011-3021

1997

Volltextzugriff (PDF)

Solvation energies from the linear response function of density functional theory

Chemical physics letters, 1996-09, Vol.260 (1), p.236-242

1996

Volltextzugriff (PDF)

Theory of molecular orbital energy shifting induced by electrostatic external effects

International journal of quantum chemistry, 1990-03, Vol.38 (S24), p.89-96

1990

Volltextzugriff (PDF)

The electrophilicity index in organic chemistry

Theoretical Aspects of Chemical Reactivity, 2006, Vol.19

2006

Volltextzugriff (PDF)

Molecular modelling of lithium intercalation in

Journal of physics. Condensed matter, 1997-04, Vol.9 (14), p.3011-3021

1997

Volltextzugriff (PDF)

1 – 25 von 50

Suche als RSS-Feed

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(45)
Mit Volltextzugriff
(47)

Publikationsform

Artikel
(48)
Buchkapitel
(2)

Sprache

Erscheinungsjahr

n.n

Menü

Weitere Dienste

Einstellungen

Design and impact of a stoichiometry voluntary online course for entering first-year STEM college students

A DFT Study of the Regioselectivity in Intramolecular Diels-Alder Reactions with Formation of a Tricyclodecane Skeleton

Lewis Molecular Acidity of Ionic Liquids from Empirical Energy–Density Models

BACK TO BASICS: MODERN REACTIVITY CONCEPTS WITHIN THE HMO THEORY FRAMEWORK è

An Aromaticity Scale Based on the Topological Analysis of the Electron Localization Function Including σ and π Contributions

Group electrophilicity as a model of nucleofugality in nucleophilic substitution reactions

Electrophilicity of quinones and its relationship with hydride affinity

Invariance of electrophilicity of independent fragments. Application to intramolecular Diels–Alder reactions

On the catalytic effect of water in the intramolecular Diels–Alder reaction of quinone systems: a theoretical study

Bond Fukui Functions As Descriptor of the Electron Density Reorganization in π Conjugated Systems

Broken symmetry analysis of spin coupling in iron-sulfur clusters

Comparison between Experimental and Theoretical Scales of Electrophilicity in Benzhydryl Cations

A Theoretical Study on the Reaction Mechanism for the Bergman Cyclization from the Perspective of the Electron Localization Function and Catastrophe Theory

Permanent group effect on nucleofugality in aryl benzoates

Empirical scale of nucleophilicity for substituted pyridines

Nucleofugality index in α-elimination reactions

Substituent effects in the mechanism of mono-substituted acetylene trimerization: A topological analysis of the electron localization function

Proton transport catalysis in intramolecular rearrangements: A density functional theory study

Comparison between Experimental and Theoretical Scales of Electrophilicity Based on Reactivity Indexes

Two state reactivity mechanism for the rearrangement of hydrogen peroxynitrite to nitric acid

Molecular modelling of lithium intercalation in 1T-TiS2

Solvation energies from the linear response function of density functional theory

Theory of molecular orbital energy shifting induced by electrostatic external effects

The electrophilicity index in organic chemistry

Molecular modelling of lithium intercalation in

Suchergebnisse filtern