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3,4,5-Triethoxybenzoic acid benzene solvate: An example of hydrogen-bonded carboxylic acid dimer

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Abstract

Crystals of 3,4,5-triethoxybenzoic acid benzene solvate, 3,4,5-(C2H5O)3C6H2COOH⋅ 0.25C6H6, are monoclinic, space group P2/c, with the cell dimensions at 100 K: a = 18.729(3), b = 10.6475(17), c = 14.390(2) Å, β = 98.410(2)∘, V = 2838.7(8) Å3, and Z = 8, Z′ = 2. In the crystal structure two symmetrically independent molecules of 3,4,5-triethoxybenzoic acid form a planar dimer by two O–H⋅sO hydrogen bonds.

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Authors and Affiliations

  1. Department of Chemistry and Biochemistry, University of California, San Diego, La Jolla, California, 92093-0358, USA

    Lev N. Zakharov & Arnold L. Rheingold

  2. Department of Chemistry, Oakland University, 2200 N. Squirrel Rd., Rochester, Michigan, 48309-4477, USA

    Roman Dembinski

Authors
  1. Lev N. Zakharov
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  2. Arnold L. Rheingold
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  3. Roman Dembinski
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Correspondence to Roman Dembinski.

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Zakharov, L.N., Rheingold, A.L. & Dembinski, R. 3,4,5-Triethoxybenzoic acid benzene solvate: An example of hydrogen-bonded carboxylic acid dimer. J Chem Crystallogr 35, 783–787 (2005). https://doi.org/10.1007/s10870-005-3963-0

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  • DOI: https://doi.org/10.1007/s10870-005-3963-0

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