Details

Hydrogen Bonding - New Insights


Hydrogen Bonding - New Insights


Challenges and Advances in Computational Chemistry and Physics, Band 3

von: Slawomir Grabowski

309,23 €

Verlag: Springer
Format: PDF
Veröffentl.: 07.10.2006
ISBN/EAN: 9781402048531
Sprache: englisch
Anzahl Seiten: 519

Dieses eBook enthält ein Wasserzeichen.

Beschreibungen

<P>Hydrogen Bonding – New Insights is an extensive text which takes numerous examples from experimental studies and uses these to illustrate theoretical investigations to allow a greater understanding of hydrogen bonding phenomenon. The most important topics in recent studies are considered including: </P>
<P>Intra-molecular H-bonds</P>
<P>Differences between H-bond and van der Waals interactions from one side and covalent bonds from the other</P>
<P>Bader theory to analyze H-bonding</P>
<P>Influence of weak H-bonds upon structure and function of biological molecules</P>
<P>H-bonds in crystal structures</P>
<P>With contributions from some of the foremost experts in this field this volume provides an invaluable resource for all members of the academic community looking for a comprehensive text on hydrogen bonding. It will be of particular interest to physical and theoretical chemists, spectroscopists, crystallographers and those involved with chemical physics.</P>
Characterization of Hydrogen Bonding: From van der Waals Interactions to Covalency.- Intramolecular Hydrogen Bonds. Methodologies and Strategies for Their Strength Evaluation.- Changes of Electron Properties in the Formation of Hydrogen Bonds.- Weak to Strong Hydrogen Bonds.- The Nature of the C–H· · ·X Intermolecular Interactions in Molecular Crystals. A Theoretical Perspective.- Weak Hydrogen Bonds Involving Transition Elements.- Contribution of CH· · ·X Hydrogen Bonds to Biomolecular Structure.- Neutral Blue-Shifting and Blue-Shifted Hydrogen Bonds.- Hydrogen–Hydrogen Bonding: The Non-Electrostatic Limit of Closed-Shell Interaction Between Two Hydro.- Potential Energy Shape for the Proton Motion in Hydrogen Bonds Reflected in Infrared and NMR Spectra.- Molecular Geometry—Distant Consequences of H-Bonding.- Topology of X-Ray Charge Density of Hydrogen Bonds.- Structure–Property Relations for Hydrogen-Bonded Solids.- Unrevealing the Nature of Hydrogen Bonds: ?-Electron Delocalization Shapes H-Bond Features. Intramolecular and Intermolecular Resonance-Assisted Hydrogen Bonds.
<P>Hydrogen Bonding – New Insights</P>
<P></P>
<P>Slawomir J. Grabowski</P>
<P></P>
<P></P>
<P>Hydrogen Bonding – New Insights is an extensive text which takes numerous examples from experimental studies and uses these to illustrate theoretical investigations to allow a greater understanding of hydrogen bonding phenomenon. The most important topics in recent studies are considered including: </P>
<P></P>
<UL>
<P>
<LI>Intra-molecular H-bonds</LI>
<P></P>
<P>
<LI>Differences between H-bond and van der Waals interactions from one side and covalent bonds from the other</LI>
<P></P>
<P>
<LI>Bader theory to analyze H-bonding</LI>
<P></P>
<P>
<LI>Influence of weak H-bonds upon structure and function of biological molecules</LI>
<P></P>
<P>
<LI>H-bonds in crystal structures</LI>
<P></P></UL>
<P></P>
<P>With contributions from some of the foremost experts in this field this volume provides an invaluable resource for all members of the academic community looking for a comprehensive text on hydrogen bonding. It will be of particular interest to physical and theoretical chemists, spectroscopists, crystallographers and those involved with chemical physics. </P>
<P></P>
Links theoretical studies with experimental results Covers the most important recent aspects in H-bonding Includes numerous examples to allow a greater understanding of H-bonding

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