Literature DB >> 17690782

Molecular recognition in the gas phase. Dipole-bound complexes of benzonitrile with water, ammonia, methanol, acetonitrile, and benzonitrile itself.

David R Borst1, David W Pratt, Martin Schäfer.   

Abstract

Described herein are the high resolution fluorescence excitation spectra of 1 : 1 complexes of benzonitrile with water, ammonia, methanol, acetonitrile, and benzonitrile itself in the gas phase. Analyses of these spectra yield the equilibrium geometries of each species in both the ground and excited electronic states, and therefore provide information about the intermolecular interactions that are responsible for holding them together, in the absence of perturbing solvent molecules. In all cases, the determined structure corresponds to the one expected on the basis of interacting dipole moments; in some cases, significant internal motions of one component relative to the other, leading to a time-varying dipole field, also has been observed.

Entities:  

Year:  2007        PMID: 17690782     DOI: 10.1039/b705679f

Source DB:  PubMed          Journal:  Phys Chem Chem Phys        ISSN: 1463-9076            Impact factor:   3.676


  2 in total

Review 1.  Excitonic splittings in molecular dimers: why static ab initio calculations cannot match them.

Authors:  Philipp Ottiger; Horst Köppel; Samuel Leutwyler
Journal:  Chem Sci       Date:  2015-08-26       Impact factor: 9.825

2.  Simulation Investigation of Bulk and Surface Properties of Liquid Benzonitrile: Ring Stacking-Assessment and Deconvolution.

Authors:  Leila Sakhtemanian; Mohammad Hadi Ghatee
Journal:  ACS Omega       Date:  2022-07-15
  2 in total

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