Hydrogen bond induced enhancement of Fermi resonances in N–H⋯N hydrogen bonded complexes of anilines

2018 ◽  
Vol 20 (33) ◽  
pp. 21557-21566 ◽  
Author(s):  
Saurabh Mishra ◽  
Jer-Lai Kuo ◽  
G. Naresh Patwari
Keyword(s):  
Hydrogen Bond ◽  
Hydrogen Bonding ◽  
Fermi Resonance ◽  
Alkyl Amines ◽  
Fermi Resonances ◽  
Bonded Complexes ◽  
Hydrogen Bonded

Enhancement of Fermi resonance intensities due to the formation of N–H⋯N hydrogen bonding of anilines with alkyl amines is analyzed using a two-state deperturbation model.

New supramolecular architectures using hydrogen bonding

1993 ◽  
Vol 345 (1674) ◽  
pp. 49-56 ◽  
Keyword(s):  
Hydrogen Bond ◽  
Hydrogen Bonding ◽  
Hydrogen Bond Donor ◽  
Binding Strength ◽  
Supramolecular Architectures ◽  
Self Assembling ◽  
Donor And Acceptor ◽  
The Stability ◽  
Bonded Complexes ◽  
Hydrogen Bonded

Several new multiply hydrogen bonded complexes have been studied to determine their strength and the specificity with which they form. While many factors contribute to the stability of multiply hydrogen bonded complexes, it appears that the arrangement of the hydrogen bond donor and acceptor groups is a particularly good predictor of binding strength. The results are consistent with W. L. Jorgensen’s secondary electrostatic hypothesis. The heterocyclic recognition units that have been synthesized may serve as the basis for constructing new synthetic hosts or new self-assembling systems.

Theoretical study of hydrogen bonding interactions in substituted nitroxide radicals

2021 ◽  
Author(s):  
Thufail M. Ismail ◽  
Neetha Mohan ◽  
P. K. Sajith
Keyword(s):  
Hydrogen Bonding ◽  
Interaction Energy ◽  
Electrostatic Potential ◽  
Molecular Electrostatic Potential ◽  
Theoretical Study ◽  
Nitroxide Radicals ◽  
Hydrogen Bonding Interactions ◽  
Bonded Complexes ◽  
Hydrogen Bonded

Interaction energy (Eint) of hydrogen bonded complexes of nitroxide radicals can be assessed in terms of the deepest minimum of molecular electrostatic potential (Vmin).

scholarly journals A test of ab initio-generated, radial intermolecular potential energy functions for five axially-symmetric, hydrogen-bonded complexes B⋯HF, where B = N2, CO, PH3, HCN and NH3

2021 ◽  
Vol 23 (12) ◽  
pp. 7271-7279
Author(s):  
Anthony C. Legon
Keyword(s):  
Hydrogen Bond ◽  
Potential Energy ◽  
Ab Initio ◽  
Intermolecular Potential ◽  
Axially Symmetric ◽  
Energy Functions ◽  
Potential Energy Functions ◽  
Acceptor Atom ◽  
Bonded Complexes ◽  
Hydrogen Bonded

Radial P.E. functions of hydrogen-bonded complexes B⋯HF (B = N2, CO, PH3, HCN and NH3) have been calculated ab initio at the CCSD(T)(F12C)/cc-pVTZ-F12 level as a function of the hydrogen-bond length r(Z⋯H), where Z is the H-bond acceptor atom of B.

scholarly journals Studies of Hydrogen Bonding. Part XXXII. The Structure of Hydrogen-bonded Complexes between p-Fluorophenol and Various Nitriles.

1985 ◽  
Vol 39b ◽  
pp. 583-587 ◽  
Author(s):  
Åsmund Austerheim ◽  
Thor Gramstad ◽  
Christina Moberg ◽  
G. Doyle Daves, Jr. ◽  
Stefan C. T. Svensson ◽  
...  
Keyword(s):  
Hydrogen Bonding ◽  
Bonded Complexes ◽  
Hydrogen Bonded

scholarly journals Studies of Hydrogen Bonding. Part XXXVI. Dipole Moments of Pyridines, Quinolines and Acridine, and of their Hydrogen-Bonded Complexes with Phenol.

1993 ◽  
Vol 47 ◽  
pp. 985-989 ◽  
Author(s):  
Thor Gramstad ◽  
Arne Haaland ◽  
Kjell-Gunnar Martinsen ◽  
Jürgen Vogt ◽  
Ingmar Grenthe ◽  
...  
Keyword(s):  
Hydrogen Bonding ◽  
Dipole Moments ◽  
Bonded Complexes ◽  
Hydrogen Bonded

Studies of Hydrogen Bonding. Part XXXIII. Dipole Moments of Phosphoryl Compounds and their Hydrogen-Bonded Complexes with Phenol.

1992 ◽  
Vol 46 ◽  
pp. 1087-1091 ◽  
Author(s):  
Thor Gramstad ◽  
Synnøve Liaaen-Jensen ◽  
Sergey V. Meshkov ◽  
Harri Lönnberg ◽  
Martti Dahlqvist ◽  
...  
Keyword(s):  
Hydrogen Bonding ◽  
Dipole Moments ◽  
Bonded Complexes ◽  
Hydrogen Bonded
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