Synthesis, characterization, structural elucidation and Hirshfeld surface analysis of (E)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one

The title compound (E)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one was synthesized and the product obtained was characterized by spectroscopic techniques and finally the structure was confirmed by X-ray diffraction technique. The compound crystallizes in the monoclinic crystal system w...

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Main Authors: Shivalingegowda, N., Ming, L. S., Jamalis, J., Kumar, C. S. A., Lokanath, N. K.
Format: Article
Published: Elsevier B.V. 2017
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Online Access:http://eprints.utm.my/id/eprint/75481/
https://www.scopus.com/inward/record.uri?eid=2-s2.0-85013345387&doi=10.1016%2fj.cdc.2017.01.004&partnerID=40&md5=b3efefb846a1dce4e5d2ce15f9db90a0
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spelling my.utm.754812018-03-13T18:09:22Z http://eprints.utm.my/id/eprint/75481/ Synthesis, characterization, structural elucidation and Hirshfeld surface analysis of (E)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one Shivalingegowda, N. Ming, L. S. Jamalis, J. Kumar, C. S. A. Lokanath, N. K. QD Chemistry The title compound (E)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one was synthesized and the product obtained was characterized by spectroscopic techniques and finally the structure was confirmed by X-ray diffraction technique. The compound crystallizes in the monoclinic crystal system with the space group P21/c with the unsaturated keto group in a -syn-iperiplanar conformation with respect to the olefinic double bond. Hirshfeld surface analysis for visually analyzing intermolecular interactions in crystal structures employing molecular surface contours and 2D fingerprint plots have been used to examine molecular shapes. Elsevier B.V. 2017 Article PeerReviewed Shivalingegowda, N. and Ming, L. S. and Jamalis, J. and Kumar, C. S. A. and Lokanath, N. K. (2017) Synthesis, characterization, structural elucidation and Hirshfeld surface analysis of (E)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one. Chemical Data Collections, 7-8 . pp. 58-67. ISSN 2405-8300 https://www.scopus.com/inward/record.uri?eid=2-s2.0-85013345387&doi=10.1016%2fj.cdc.2017.01.004&partnerID=40&md5=b3efefb846a1dce4e5d2ce15f9db90a0
institution Universiti Teknologi Malaysia
building UTM Library
collection Institutional Repository
continent Asia
country Malaysia
content_provider Universiti Teknologi Malaysia
content_source UTM Institutional Repository
url_provider http://eprints.utm.my/
topic QD Chemistry
spellingShingle QD Chemistry
Shivalingegowda, N.
Ming, L. S.
Jamalis, J.
Kumar, C. S. A.
Lokanath, N. K.
Synthesis, characterization, structural elucidation and Hirshfeld surface analysis of (E)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one
description The title compound (E)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one was synthesized and the product obtained was characterized by spectroscopic techniques and finally the structure was confirmed by X-ray diffraction technique. The compound crystallizes in the monoclinic crystal system with the space group P21/c with the unsaturated keto group in a -syn-iperiplanar conformation with respect to the olefinic double bond. Hirshfeld surface analysis for visually analyzing intermolecular interactions in crystal structures employing molecular surface contours and 2D fingerprint plots have been used to examine molecular shapes.
format Article
author Shivalingegowda, N.
Ming, L. S.
Jamalis, J.
Kumar, C. S. A.
Lokanath, N. K.
author_facet Shivalingegowda, N.
Ming, L. S.
Jamalis, J.
Kumar, C. S. A.
Lokanath, N. K.
author_sort Shivalingegowda, N.
title Synthesis, characterization, structural elucidation and Hirshfeld surface analysis of (E)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one
title_short Synthesis, characterization, structural elucidation and Hirshfeld surface analysis of (E)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one
title_full Synthesis, characterization, structural elucidation and Hirshfeld surface analysis of (E)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one
title_fullStr Synthesis, characterization, structural elucidation and Hirshfeld surface analysis of (E)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one
title_full_unstemmed Synthesis, characterization, structural elucidation and Hirshfeld surface analysis of (E)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one
title_sort synthesis, characterization, structural elucidation and hirshfeld surface analysis of (e)-3-(3-methylthiophen-2-yl)-1-(pyrazin-2-yl)prop-2-en-1-one
publisher Elsevier B.V.
publishDate 2017
url http://eprints.utm.my/id/eprint/75481/
https://www.scopus.com/inward/record.uri?eid=2-s2.0-85013345387&doi=10.1016%2fj.cdc.2017.01.004&partnerID=40&md5=b3efefb846a1dce4e5d2ce15f9db90a0
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score 13.211869