European Journal of Chemistry

Hydrogen bonding framework in imidazole derivatives: Crystal structure and Hirshfeld surface analysis

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Praveen Singh
Ranjeet Kumar
Ashish Kumar Tewari

Abstract

A series of imidazole derivatives (1-3) were synthesized with three component reaction among benzil, ammonium acetate and formaldehyde/aromatic aldehyde at 110 °C without a catalyst and solvent. These synthesized imidazole derivatives have shown intermolecular hydrogen bonding such as N-H···N and O-H···N. The imidazole 1 and 2 exhibited N-H···N intermolecular hydrogen bonding while imidazole 3 exhibited O-H···N intermolecular hydrogen bonding. The hydrogen bonds in imidazoles were studied by X-ray crystallography and Hirshfeld Surface Analysis at dnorm surface which show the visible red spots, indicated for hydrogen bonds. Further, Hirshfeld surface analysis also shows the percentage of all intermolecular interactions.


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Singh, P.; Kumar, R.; Tewari, A. K. Hydrogen Bonding Framework in Imidazole Derivatives: Crystal Structure and Hirshfeld Surface Analysis. Eur. J. Chem. 2020, 11, 50-59.

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Supporting Agencies

University Grant Commission (Grant Sanction No. 37-54/2009), India, Department of Chemistry, Banaras Hindu University, Varanasi, India.
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