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Crystal structure of 4-ethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, C14H12N4O3S

C14H12N4O3S, monoclinic, P21/n (no. 14), a = 12.2777(3) Å, b = 9.4312(2) Å, c = 12.9412(2) Å, β = 107.945(2)°, V = 1425.61(5) Å3, Z = 4, R gt (F) = 0.0305, wR ref (F 2) = 0.0837, T = 160 K. CCDC no.: 2059188 The molecular structure is shown in the figure. Table 1 contains crystallographic data a...

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Main Authors: El-Emam, Ali A., Al-Whaibi, Lamya H., Blacque, Olivier, Tiekink, Edward R. T. *
Format: Article
Published: De Gruyter Open 2022
Subjects:
QD Chemistry
Online Access:http://eprints.sunway.edu.my/2113/
https://doi.org/10.1515/ncrs-2022-0272
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spelling my.sunway.eprints.21132022-09-08T02:43:20Z http://eprints.sunway.edu.my/2113/ Crystal structure of 4-ethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, C14H12N4O3S El-Emam, Ali A. Al-Whaibi, Lamya H. Blacque, Olivier Tiekink, Edward R. T. * QD Chemistry C14H12N4O3S, monoclinic, P21/n (no. 14), a = 12.2777(3) Å, b = 9.4312(2) Å, c = 12.9412(2) Å, β = 107.945(2)°, V = 1425.61(5) Å3, Z = 4, R gt (F) = 0.0305, wR ref (F 2) = 0.0837, T = 160 K. CCDC no.: 2059188 The molecular structure is shown in the figure. Table 1 contains crystallographic data and Table 2 contains the list of the atoms including atomic coordinates and displacement parameters. De Gruyter Open 2022-07-05 Article PeerReviewed El-Emam, Ali A. and Al-Whaibi, Lamya H. and Blacque, Olivier and Tiekink, Edward R. T. * (2022) Crystal structure of 4-ethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, C14H12N4O3S. Zeitschrift für Kristallographie - New Crystal Structures, 237 (5). pp. 811-814. ISSN 2197-4578 https://doi.org/10.1515/ncrs-2022-0272 10.1515/ncrs-2022-0272
institution Sunway University
building Sunway Campus Library
collection Institutional Repository
continent Asia
country Malaysia
content_provider Sunway University
content_source Sunway Institutional Repository
url_provider http://eprints.sunway.edu.my/
topic QD Chemistry
spellingShingle QD Chemistry
El-Emam, Ali A.
Al-Whaibi, Lamya H.
Blacque, Olivier
Tiekink, Edward R. T. *
Crystal structure of 4-ethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, C14H12N4O3S
description C14H12N4O3S, monoclinic, P21/n (no. 14), a = 12.2777(3) Å, b = 9.4312(2) Å, c = 12.9412(2) Å, β = 107.945(2)°, V = 1425.61(5) Å3, Z = 4, R gt (F) = 0.0305, wR ref (F 2) = 0.0837, T = 160 K. CCDC no.: 2059188 The molecular structure is shown in the figure. Table 1 contains crystallographic data and Table 2 contains the list of the atoms including atomic coordinates and displacement parameters.
format Article
author El-Emam, Ali A.
Al-Whaibi, Lamya H.
Blacque, Olivier
Tiekink, Edward R. T. *
author_facet El-Emam, Ali A.
Al-Whaibi, Lamya H.
Blacque, Olivier
Tiekink, Edward R. T. *
author_sort El-Emam, Ali A.
title Crystal structure of 4-ethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, C14H12N4O3S
title_short Crystal structure of 4-ethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, C14H12N4O3S
title_full Crystal structure of 4-ethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, C14H12N4O3S
title_fullStr Crystal structure of 4-ethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, C14H12N4O3S
title_full_unstemmed Crystal structure of 4-ethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, C14H12N4O3S
title_sort crystal structure of 4-ethyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-6-oxo-1,6-dihydropyrimidine-5-carbonitrile, c14h12n4o3s
publisher De Gruyter Open
publishDate 2022
url http://eprints.sunway.edu.my/2113/
https://doi.org/10.1515/ncrs-2022-0272
_version_ 1744357027364208640
score 13.211869

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