Polar solvent fluctuations drive proton transfer in hydrogen bonded complexes of carboxylic acid with pyridines: NMR, IR and ab initio MD study

The Hydrated Excess Proton in the Zundel Cation H5 O2 + : The Role of Ultrafast Solvent Fluctuations

(2016) Fabian Dahms et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Effect of solvent on proton location and dynamic behavior in short intramolecular hydrogen bonds studied by molecular dynamics simulations and NMR experiments

(2015) Yukie Mori et al.   CHEMICAL PHYSICS

Correlating Photoacidity to Hydrogen-Bond Structure by Using the Local O–H Stretching Probe in Hydrogen-Bonded Complexes of Aromatic Alcohols

(2015) Brian T. Psciuk et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Proton transfer in a short hydrogen bond caused by solvation shell fluctuations: an ab initio MD and NMR/UV study of an (OHO)− bonded system

(2015) Svetlana Pylaeva et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Simulating the vibrational spectra of ionic liquid systems: 1-Ethyl-3-methylimidazolium acetate and its mixtures

(2014) Martin Thomas et al.   JOURNAL OF CHEMICAL PHYSICS

Structural Dynamics of Hydrated Phospholipid Surfaces Probed by Ultrafast 2D Spectroscopy of Phosphate Vibrations

(2014) Rene Costard et al.   Journal of Physical Chemistry Letters

Solvent and H/D Isotope Effects on the Proton Transfer Pathways in Heteroconjugated Hydrogen-Bonded Phenol-Carboxylic Acid Anions Observed by Combined UV–vis and NMR Spectroscopy

(2013) Benjamin Koeppe et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

NMR and FT-IR Studies on the Association of Derivatives of Thymidine, Adenosine, and 6-N-Methyl-Adenosine in Aprotic Solvents

(2013) Benjamin Koeppe et al.   ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS

NMR Studies of Solid Pentachlorophenol-4-Methylpyridine Complexes Exhibiting Strong OHN Hydrogen Bonds: Geometric H/D Isotope Effects and Hydrogen Bond Coupling Cause Isotopic Polymorphism

(2012) Brenda C. K. Ip et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Hydrogen Bond Geometries and Proton Tautomerism of Homoconjugated Anions of Carboxylic Acids Studied via H/D Isotope Effects on 13C NMR Chemical Shifts

(2012) Jing Guo et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Hydrogen Bonding in Pyridine N-Oxide/Acid Systems: Proton Transfer and Fine Details Revealed by FTIR, NMR, and X-ray Diffraction

(2012) Vytautas Balevicius et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Reorientation and Allied Dynamics in Water and Aqueous Solutions

(2011) Damien Laage et al.   Annual Review of Physical Chemistry

TRAVIS - A Free Analyzer and Visualizer for Monte Carlo and Molecular Dynamics Trajectories

(2011) Martin Brehm et al.   Journal of Chemical Information and Modeling

Two-Dimensional UV–vis/NMR Correlation Spectroscopy: A Heterospectral Signal Assignment of Hydrogen-Bonded Complexes

(2011) Benjamin Koeppe et al.   Journal of Physical Chemistry Letters

Reaction Pathways of Proton Transfer in Hydrogen-Bonded Phenol–Carboxylate Complexes Explored by Combined UV–Vis and NMR Spectroscopy

(2011) Benjamin Koeppe et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Ultrafast Vibrational Dynamics and Local Interactions of Hydrated DNA

(2010) Łukasz Szyc et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Geometries and Tautomerism of OHN Hydrogen Bonds in Aprotic Solution Probed by H/D Isotope Effects on13C NMR Chemical Shifts

(2010) Peter M. Tolstoy et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Large Angular Jump Mechanism Observed for Hydrogen Bond Exchange in Aqueous Perchlorate Solution

(2010) M. Ji et al.   SCIENCE

Combined NMR and UV/Vis Spectroscopy in the Solution State: Study of the Geometries of Strong OHO Hydrogen Bonds of Phenols with Carboxylic Acids

(2009) Peter M. Tolstoy et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Broadband dielectric response of dichloromethane

(2009) Johannes Hunger et al.   CHEMICAL PHYSICS LETTERS

Vibrational Spectroscopy as a Probe of Structure and Dynamics in Liquid Water

(2009) H. J. Bakker et al.   CHEMICAL REVIEWS

OHO Hydrogen Bond Geometries and NMR Chemical Shifts: From Equilibrium Structures to Geometric H/D Isotope Effects, with Applications for Water, Protonated Water, and Compressed Ice

(2009) Hans-Heinrich Limbach et al.   ISRAEL JOURNAL OF CHEMISTRY

High-Resolution Vibrational Spectroscopy oftrans-Formic Acid in Solid Parahydrogen

(2009) Leif O. Paulson et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Rational Design of Highly Active and Selective Ligands for the α5β1 Integrin Receptor

(2008) Dominik Heckmann et al.   CHEMBIOCHEM

Structural Dynamics of Aqueous Salt Solutions

(2008) H. J. Bakker   CHEMICAL REVIEWS

Correlation between the Hydrogen-Bond Structures and the CO Stretching Frequencies of Carboxylic Acids as Studied by Density Functional Theory Calculations: Theoretical Basis for Interpretation of Infrared Bands of Carboxylic Groups in Proteins

(2008) Ken-ichi Takei et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Weak Hydrogen Bonds Make a Difference: Dimers of Jet-Cooled Halogenated Ethanols

(2008) Tina Scharge et al.   ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS