Abstract
The structures of the title compounds, tris(2-hydroxy-3-t-butyl-5-methylbenzene)-methane)C34H46O3.3H2O, 3) and N-benzyl-N-phenylbenzamide (C20H17NO, 6), have been investigated by X-ray crystallography. Compound 3 crystallizes in the trigonal space group \(P\bar 3 \) with cell parameters a = 14.090(5) Å, b = 14.090(5)Å, c = 10.485(5)Å, Z = 2. Compound 6 crystallizes in the monoclinic space group C2/c with cell parameters a = 24.533(4)Å, b = 9.176(4)Å, c = 16.711(5)Å, β = 125.88(2)°, Z = 8. Compound 3 has both intra-and intermolecular hydrogen bonds. It also exhibits a helical columnar arrangement of the molecules and goes into mesophase before melting into an isotropic liquid.
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Cardillo, B.; Casnati, G.; Pochini, A. Chim. Ind. 1967, 49, 630.
TeXsan, Single Crystal Structure Analysis Software, version 1.7.; Molecular Structure Corp.: The Woodlands; TX, 1995.
Sheldrick, G. M. Acta Crystallogr. 1990, A46, 467.
Sheldrick, G.M. SHELXL97, Program for Crystal Structure Refinement; University of Göttingen: Germany, 1997.
Altomare, A.; Cascarano, G.; Giacovazzo, C.; Guagliardi, A. J. Appl. Crystallogr. 1993, 26, 343.
Spek, A.L. Acta Crystallogr. 1990, A46, C-34.
Blount, J.F.; Mislow, K. Tetrahedron Lett. 1975, 11, 909.
Macnicol, D.D.; Mallinson, P.R.; Tominey, G. J. Chem. Res., Synop. 1986, 278.
Veldman, N.; Spek, A.L.; Schlotter, J.J.H.; Zwikker, J.W.; Jenneskens, L.W. Acta Crystallogr. 1996, C52, 174.
Rajca, A.; Janicki, S. J. Org. Chem. 1994, 59, 7099.
Heiney, P.A.; Fontes, E.; de Jeu, W.H.; Riera, A.; Caroll, P.; Smith, A.B. J. Phys. (Paris) 1989, 50, 461.
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Rangappa, K.S., Mallesha, H., Anilkumar, N.V. et al. Crystal and molecular structure studies of tris(2-hydroxy-3-t-butyl-5-methylbenzene)-methane trihydrate and N-benzyl-N-phenyl benzamide. Journal of Chemical Crystallography 30, 255–258 (2000). https://doi.org/10.1023/A:1009595123416
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DOI: https://doi.org/10.1023/A:1009595123416