New PDF release: Aromatic Interactions Frontiers in Knowledge and Application

By Darren W Johnson, Fraser Hof, Philip Gale, Jonathan Steed, Shimizu Ken, Michael Lewis, Pablo Ballester Balaguer, Ed Tiekink, Steven Wheeler, Felix Fischer, Waters Marcey, Urbach Adam

ISBN-10: 1782624171

ISBN-13: 9781782624172

ISBN-10: 178262662X

ISBN-13: 9781782626626

ISBN-10: 1782629599

ISBN-13: 9781782629597

The box of fragrant interactions, the elemental nature of substituent results and the identity of contacts among anions and fragrant structures have generated stimulating arguments in recent times. New theoretical frameworks were built and confirmed and fragrant interactions have emerged as capability options for various difficulties in biology and fabrics technological know-how.


This publication presents a panoramic survey of the newest findings and advances surrounding fragrant interactions, stretching from the basics to fashionable functions in synthesis, biology and fabrics chemistry. It additionally discusses computational, experimental and analytical methods to knowing those interactions, together with pi-pi, anion-pi, and cation-pi interactions.


Aromatic Interactions: Frontiers in wisdom and Application is an invaluable textual content for complicated scholars and researchers, and appeals to these operating in the fields of supramolecular chemistry, computational chemistry and thermodynamics.

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Extra info for Aromatic Interactions Frontiers in Knowledge and Application

Example text

Int. , 2008, 47, 3430. M. O. Sinnokrot and C. D. Sherrill, J. Phys. Chem. A, 2006, 110, 10656. F. Cozzi, M. Cinquini, R. Annunziata, T. Dwyer and J. S. Siegel, J. Am. Chem. , 1992, 114, 5729. F. Cozzi, M. Cinquini, R. Annunziata and J. S. Siegel, J. Am. Chem. , 1993, 115, 5330. F. Cozzi, F. Ponzini, R. Annunziata, M. Cinquini and J. S. Siegel, Angew. , Int. , 1995, 34, 1019. F. Cozzi and J. S. Siegel, Pure Appl. , 1995, 67, 683. F. Cozzi, R. Annunziata, M. Benaglia, M. Cinquini, L.

We develop the discussion under three main headings. First, the physical nature of the interaction is explained for assimilation by a wide readership. Second, we select several examples of anion–π interactions in solution within host–guest systems, catalysis and ionic liquids. Third, we highlight recent examples from the literature where the anion–π interactions are very relevant for understanding the solid-state architecture of crystalline materials. 56–58 The electrostatic term in neutral arenes correlates well with the adequate component (perpendicular to the ring plane) of the quadrupole moment (Qzz).

A Monte-Carlo conformational search followed by mixed QM/QM calculations [ONIOM(B3LYP/6-31(d): AM1)] were employed to find the low lying TS. It was observed the lowest energy TS corresponding to si-facial endo addition (with respect to the aldehyde) is stabilized by a CH/π interaction between the aldehyde CH and the pseudoequatorial naphthyl group of the TADDOL catalyst. ,90 along with a key transition state stabilized by CH/π interactions. Adapted with permission from Org. , 2008, 10, 2749–2752.

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Aromatic Interactions Frontiers in Knowledge and Application by Darren W Johnson, Fraser Hof, Philip Gale, Jonathan Steed, Shimizu Ken, Michael Lewis, Pablo Ballester Balaguer, Ed Tiekink, Steven Wheeler, Felix Fischer, Waters Marcey, Urbach Adam


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