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Persistent Hydrogen‐Bonded and Non‐Hydrogen‐Bonded Phenoxyl Radicals

Chemistry – A European Journal, 2011
AbstractThe production of stable phenoxyl radicals is undoubtedly a synthetic chemical challenge. Yet it is a useful way to gain information on the properties of the biological tyrosyl radicals. Recently, several persistent phenoxyl radicals have been reported, but only limited synthetic variations could be achieved.
Riccardo, Wanke   +4 more
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Hydrogen–hydrogen bonding: The current density perspective

Journal of Computational Chemistry, 2015
Current density plots of closed‐shell intermolecular HH interactions characterized by a bond critical point (BCP) show two vortices separated by a saddle, a pattern which allows for a clear definition of a pair current strength. This HH current strength turns out to be roughly related to the potential energy density at the BCP and then to the ...
Della Porta, Paolo   +2 more
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Hydrogen Bonding Is Not Everything: Extensive Polymorphism in a System with Conserved Hydrogen Bonded Synthons

Crystal Growth & Design, 2009
A simple N,N′-diaryl urea derivative was found to form four different anhydrous crystal forms (I−IV°), which can be crystallized in pure form by several techniques from solution as well as from the melt. These polymorphs were characterized by thermomicroscopy, differential scanning calorimetry, Fourier-transform infrared spectroscopy and single crystal
Edkins, Katharina   +4 more
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Hydrogen Bonds of Anilines

ChemInform, 2007
AbstractChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 200 leading journals. To access a ChemInform Abstract, please click on HTML or PDF.
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Bond energies and hydrogen density distributions for hydrogen bond

Zeitschrift für Naturforschung A, 2023
Abstract The three-body problem for hydrogen bond (X–Y–X; Y=H or D) is discussed assuming symmetrical double minimum of the Morse potentials (X–Y). Two types for hydrogen bond energies are estimated by deriving the confocal elliptic differential equation, and the lowest energy for hydrogen bond may be estimated using the trial function ...
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Hydrogen-Bonding: An update

Crystallography Reviews, 1995
This article focusses on the crystallographic research aimed at a better understanding of hydrogen bonds which has been published since January 1990. In the interest of continuity, earlier work is quoted when it relates to that published during this period.
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The Hydrogen Bond, Front and Center

Angewandte Chemie International Edition, 2010
Peer ...
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Hydrogen bonding: the role of hydrogen delocalization in the AHB bond

The Journal of Physical Chemistry, 1993
The behavior of the A-H...B multiple minimum hydrogen bond can be understood in terms of an analysis similar to the molecular orbital method in molecular electronic quantum theory. Delocalization of hydrogen about two or more wells is described in terms of a linear combination of Gaussian orbitals, each referred to a well minimum.
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Hydrogen Bonding, Hydrogen Transfer, and Halogen Bonding

2023
Chaoyang Zhang, Jing Huang, Rupeng Bu
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