Intramolecular Hydrogen Bond in Biologically Active o-Carbonyl Hydroquinones

Competing intramolecular NHOC hydrogen bonds and extended intermolecular network in 1-(4-chlorobenzoyl)-3-(2-methyl-4-oxopentan-2-yl) thiourea analyzed by experimental and theoretical methods

(2014) Aamer Saeed et al.   CHEMICAL PHYSICS

Biological Evaluation of 3-Acyl-2-Arylamino-1,4-Naphthoquinones as Inhibitors of Hsp90 Chaperoning Function

(2013) David Rios et al.   CURRENT TOPICS IN MEDICINAL CHEMISTRY

Resonance assisted hydrogen bonds in open-chain and cyclic structures of malonaldehyde enol: A theoretical study

(2013) Cristina Trujillo et al.   JOURNAL OF MOLECULAR STRUCTURE

DFT molecular orbital calculations and natural bond orbital analysis of 1,2,7-thiadiazepane conformers

(2013) Mina Haghdadi   MONATSHEFTE FUR CHEMIE

Origin of Binding of Ammonia–Borane to Transition-Metal-Based Catalysts: An Insight from the Charge and Energy Decomposition Method ETS-NOCV

(2013) Monika Parafiniuk et al.   ORGANOMETALLICS

An ortho-carbonyl substituted hydroquinone derivative is an anticancer agent that acts by inhibiting mitochondrial bioenergetics and by inducing G2/M-phase arrest in mammary adenocarcinoma TA3

(2013) Félix A. Urra et al.   TOXICOLOGY AND APPLIED PHARMACOLOGY

On the mechanism of biological activity of hydroquinone derivatives that inhibit tumor cell respiration. A theoretical study

(2013) Jorge Soto-Delgado et al.   Computational and Theoretical Chemistry

An Unexpected and Significantly Lower Hydrogen-Bond-Donating Capacity of Fluorohydrins Compared to Nonfluorinated Alcohols

(2012) Jérôme Graton et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Geometrical criteria versus quantum chemical criteria for assessment of intramolecular hydrogen bond (IMHB) interaction: A computational comparison into the effect of chlorine substitution on IMHB of salicylic acid in its lowest energy ground state conformer

(2012) Bijan Kumar Paul et al.   CHEMICAL PHYSICS

In situ characterization by cyclic voltammetry and conductance of composites based on polypyrrole, multi-walled carbon nanotubes and cobalt phthalocyanine

(2012) Ana Gabriela Porras-Gutiérrez et al.   ELECTROCHIMICA ACTA

2,5-Dihydroxyacetophenone Isolated from Rehmanniae Radix Preparata Inhibits Inflammatory Responses in Lipopolysaccharide-Stimulated RAW264.7 Macrophages

(2012) Yunkyung Han et al.   JOURNAL OF MEDICINAL FOOD

Substituent effects on the intramolecular hydrogen bond in 1-hydroxyanthraquinone: AIM and NBO analyses

(2012) Xiaoyan Li et al.   STRUCTURAL CHEMISTRY

Structural Features and Hydrogen-Bond Properties of Galanthamine and Codeine: An Experimental and Theoretical Study

(2011) Alexandre P. Atkinson et al.   CHEMISTRY-A EUROPEAN JOURNAL

NMR assignment in regioisomeric hydroquinones

(2011) Jose A. Dobado et al.   MAGNETIC RESONANCE IN CHEMISTRY

Defining the hydrogen bond: An account (IUPAC Technical Report)

(2011) Elangannan Arunan et al.   PURE AND APPLIED CHEMISTRY

Design and Synthesis of Novel Quinone Inhibitors Targeted to the Redox Function of Apurinic/Apyrimidinic Endonuclease 1/Redox Enhancing Factor-1 (Ape1/Ref-1)

(2010) Rodney L. Nyland et al.   JOURNAL OF MEDICINAL CHEMISTRY

Influence of “Remote” Intramolecular Hydrogen Bonds on the Stabilities of Phenoxyl Radicals and Benzyl Cations

(2010) Mario C. Foti et al.   JOURNAL OF ORGANIC CHEMISTRY

Theoretical Study of the Structures and Hydrogen-Bond Properties of New Alternated Heterocyclic Compounds

(2010) Alexandra Tabatchnik et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Theoretical study of bifurcated hydrogen bonding effects on the1J(N,H),1hJ(N,H),2hJ(N,N) couplings and1H,15N shieldings in model pyrroles

(2010) Andrei V. Afonin et al.   MAGNETIC RESONANCE IN CHEMISTRY

Hydrogen Bonding, Electrostatic Potential, and Molecular Design

(2009) Peter W. Kenny   Journal of Chemical Information and Modeling

Prediction of the Intrinsic Hydrogen Bond Acceptor Strength of Chemical Substances from Molecular Structure

(2009) Johannes Schwöbel et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Inter- or Intramolecular N···H−O or N−H···O Hydrogen Bonding in 1,3-Amino-α/β-naphthols: An Experimental NMR and Computational Study

(2009) Anica Lämmermann et al.   JOURNAL OF PHYSICAL CHEMISTRY A

A refined model for prediction of hydrogen bond acidity and basicity parameters from quantum chemical molecular descriptors

(2009) Mike Devereux et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Solvent effects on the rate of the keto–enol interconversion of 2-nitrocyclohexanone

(2008) Gabriella Siani et al.   ORGANIC & BIOMOLECULAR CHEMISTRY