skip to main content
OSTI.GOV title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Single Crystal X-ray Study of 6-Phenyl-4-(p-tolyl)pyridin-2(1H)-one

Abstract

The title compound 6-phenyl-4-(p-tolyl)pyridin-2(1H)-one was synthesized via one-pot, three component reaction of (E)-1-phenyl-3-(p-tolyl)-2-propen-1-one, ethyl 2-nitroacetate and ammonium acetate in refluxing ethanol, as a shiny green crystalline solid in 83% yield. Its structure was characterized by spectral studies and unambiguously corroborated by X-ray diffraction crystallography. The crystals of title compound are monoclinic, sp. gr. P2{sub 1}/n, a = 11.8346(7) Å, b = 13.4413(9) Å, c = 17.7626(10) Å, β = 99.479(5)°, and Z = 8. All the rings in molecule of the title compound are planar. Hydrogen interactions play significant role in stabilizing the crystal structure and the supramolecular aggregate of molecules is facilitated by strong N–H···O and C–H···O type of hydrogen interactions.

Authors:
 [1];  [2];  [1];  [2]
  1. University of Jammu, Department of Chemistry (India)
  2. University of Jammu, X-ray Crystallography Laboratory, Department of Physics and Electronics (India)
Publication Date:
OSTI Identifier:
22758291
Resource Type:
Journal Article
Journal Name:
Crystallography Reports
Additional Journal Information:
Journal Volume: 62; Journal Issue: 7; Other Information: Copyright (c) 2017 Pleiades Publishing, Inc.; Country of input: International Atomic Energy Agency (IAEA); Journal ID: ISSN 1063-7745
Country of Publication:
United States
Language:
English
Subject:
75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY; 37 INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY; ACETATES; CRYSTALLOGRAPHY; ETHANOL; HYDROGEN; HYDROGEN 1; INTERACTIONS; MOLECULES; MONOCLINIC LATTICES; MONOCRYSTALS; RINGS; SOLIDS; X-RAY DIFFRACTION; YIELDS

Citation Formats

Khajuria, Rajni, Sharma, Suresh, Kapoor, Kamal K., E-mail: kamalkka@gmail.com, and Gupta, Vivek K., E-mail: vivek-gupta2k2@hotmail.com. Single Crystal X-ray Study of 6-Phenyl-4-(p-tolyl)pyridin-2(1H)-one. United States: N. p., 2017. Web. doi:10.1134/S1063774517070227.
Khajuria, Rajni, Sharma, Suresh, Kapoor, Kamal K., E-mail: kamalkka@gmail.com, & Gupta, Vivek K., E-mail: vivek-gupta2k2@hotmail.com. Single Crystal X-ray Study of 6-Phenyl-4-(p-tolyl)pyridin-2(1H)-one. United States. doi:10.1134/S1063774517070227.
Khajuria, Rajni, Sharma, Suresh, Kapoor, Kamal K., E-mail: kamalkka@gmail.com, and Gupta, Vivek K., E-mail: vivek-gupta2k2@hotmail.com. Fri . "Single Crystal X-ray Study of 6-Phenyl-4-(p-tolyl)pyridin-2(1H)-one". United States. doi:10.1134/S1063774517070227.
@article{osti_22758291,
title = {Single Crystal X-ray Study of 6-Phenyl-4-(p-tolyl)pyridin-2(1H)-one},
author = {Khajuria, Rajni and Sharma, Suresh and Kapoor, Kamal K., E-mail: kamalkka@gmail.com and Gupta, Vivek K., E-mail: vivek-gupta2k2@hotmail.com},
abstractNote = {The title compound 6-phenyl-4-(p-tolyl)pyridin-2(1H)-one was synthesized via one-pot, three component reaction of (E)-1-phenyl-3-(p-tolyl)-2-propen-1-one, ethyl 2-nitroacetate and ammonium acetate in refluxing ethanol, as a shiny green crystalline solid in 83% yield. Its structure was characterized by spectral studies and unambiguously corroborated by X-ray diffraction crystallography. The crystals of title compound are monoclinic, sp. gr. P2{sub 1}/n, a = 11.8346(7) Å, b = 13.4413(9) Å, c = 17.7626(10) Å, β = 99.479(5)°, and Z = 8. All the rings in molecule of the title compound are planar. Hydrogen interactions play significant role in stabilizing the crystal structure and the supramolecular aggregate of molecules is facilitated by strong N–H···O and C–H···O type of hydrogen interactions.},
doi = {10.1134/S1063774517070227},
journal = {Crystallography Reports},
issn = {1063-7745},
number = 7,
volume = 62,
place = {United States},
year = {2017},
month = {12}
}