Abstract
The crystal structure is solved for a 1:1 molecular complex of pyrogallol and dimethylsulfoxide. Crystal data: C8H12O4S, M = 204.24, orthorhombic, Pna21 space group; unit cell parameters: a = 10.9620(4) Å, b = 10.9542(4) Å, c = 8.0561(3) Å, V = 967.38(6) Å3, Z = 4, d x = 1.402 g/cm3, R1 = 0.0216, T = 150 K. The molecules are joined in a supramolecular ensemble by O-H…O and C-H…π hydrogen bonds.
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T. M. Polyanskaya and K. A. Khaldoyanidi, J. Struct. Chem., 49, No. 2, 327–334 (2008).
T. M. Polyanskaya, K. A. Khaldoyanidi, and A. I. Smolentsev, J. Struct. Chem., 51, No. 2, 327–334 (2010).
T. M. Polyanskaya, K. A. Khaldoyanidi, and A. I. Smolentsev, J. Struct. Chem., 52, No. 5, 964–969 (2011).
Cambridge Structural Database. Version 5.29. University of Cambridge, UK.
Bruker AXS Inc. (2004). APEX2 (Version 1.08), SAINT (Version 7.03), SADABS (Version 2.11) and SHELXTL (Version 6.12). Bruker Advanced X-ray Solutions, Madison, Wisconsin, USA.
P. Gilli, V. Bertolasi, V. Ferretti, and G. Gilli, J. Am. Chem. Soc., 116, No. 3, 909–915 (1994).
P. Becker, H. Brusset, and H. Gillier-Pandraud, C.R. Acad. Sc. Paris, 274, No. 11, 1043–1046 (1972).
D. Martin and H. J. Hauthal, Dimethylsulfoxide, Academie. Verlag, Berlin (1971).
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Original Russian Text Copyright © 2012 by T. M. Polyanskaya, A. I. Smolentsev
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Translated from Zhurnal Strukturnoi Khimii, Vol. 53, No. 3, pp. 574–579, May–June, 2012.
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Polyanskaya, T.M., Smolentsev, A.I. Supramolecular architecture of a 1:1 complex of pyrogallol with dimethylsulfoxide. J Struct Chem 53, 568–573 (2012). https://doi.org/10.1134/S0022476612030225
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DOI: https://doi.org/10.1134/S0022476612030225