Crystal structure of mesogenic material – trans-4-propyl cyclohexyl-4-(traiis-4-pentyl cyclohexyl) benzoate

Shastry, C. I. V. and Babu, A. M. and Sridhar, M. A. and Bellad, S. B. and Indira, A. and Shashidhara Prasad, J. (1992) Crystal structure of mesogenic material – trans-4-propyl cyclohexyl-4-(traiis-4-pentyl cyclohexyl) benzoate. Zeitschrift Fur Kristallographie, 201 (3-4). pp. 177-182.

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Official URL: https://doi.org/10.1524/zkri.1992.201.14.177

Abstract

The compound (C27H42O2) crystallizes in the triclinic space group P1BAR with a = 7.292(2) angstrom, b = 11.417(2) angstrom, c = 15.175(3) angstrom, alpha = 86.27(2)-degrees, beta = 83.11(3)-degrees, gamma = 88.94(2)-degrees and two molecules per unit cell. D(c) = 1.058 Mg.m-3. The structure was solved by direct methods (MULTAN) using 1746 observed reflections I > 3.5-sigma(I)]. It was refined by block diagonal least squares method to a final Rf = 0.092 (Rw = 0.073). The central phenyl ring makes angles of 111.77(18)-degrees and 125.05(18)-degrees with the mean planes of the two cyclohexane rings. The mean planes of the two cyclohexane rings make an angle of 14.53(19)-degrees. The pairs of molecules related by a centre of symmetry form an imbricated arrangement in the crystalline state when viewed along c and a strong layering when viewed along a.

Item Type: Article
Subjects: D Physical Science > Physics
Divisions: Department of > Physics
Depositing User: Users 23 not found.
Date Deposited: 13 May 2021 04:13
Last Modified: 01 Dec 2022 06:16
URI: http://eprints.uni-mysore.ac.in/id/eprint/16480

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