Crystal structure of N-ethyl-4-[3-(trifluoromethyl)-phenyl]piperazine-1-carbothioamide, C14H18F3N3S

Al-Wahaibi, Lamya H. and Blacque, Olivier and Al-Shaalan, Nora H. and Tiekink, Edward R. T. * and El-Emam, Ali A. (2023) Crystal structure of N-ethyl-4-[3-(trifluoromethyl)-phenyl]piperazine-1-carbothioamide, C14H18F3N3S. Zeitschrift für Kristallographie - New Crystal Structures, 238 (1). pp. 45-47. ISSN 1433-7266

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Official URL: https://www.degruyter.com/document/doi/10.1515/ncr...

Abstract

C14H18F3N3S, monoclinic, P21/c (no. 14), a = 4.61919(4) Å, b = 29.1507(3) Å, c = 11.27803(10) Å, β = 94.4768(8)°, V = 1513.99(3) Å3, Z = 4, R gt (F) = 0.0588, wR ref (F 2) = 0.1579, T = 160 K. CCDC no.: 2211988 The molecular structure and supramolecular chain in the crystal are shown in the figure. Table 1 contains crystallographic data and Table 2 contains the list of the atoms including atomic coordinates and displacement parameters.

Item Type: Article
Subjects: Q Science > QD Chemistry
Divisions: Others > Non Sunway Academics
Sunway University > School of Medical and Life Sciences [formerly School of Healthcare and Medical Sciences until 2020] > Sunway Biofunctional Molecules Discovery Centre [formerly Research Centre for Crystalline Materials until 2023]
Depositing User: Ms Yong Yee Chan
Related URLs:
Date Deposited: 03 Jan 2023 00:58
Last Modified: 03 Jan 2023 01:11
URI: http://eprints.sunway.edu.my/id/eprint/2135

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