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Structure cristallographique du clathrate triclinique tri-o-thymotide–benzène (2:2,5), 2C33H36O6.2,5C6H6

Publication date1983-02-15
Abstract

Mr = 1252.6, triclinic, P1, α = 11.312 (5), b = 13.147 (3), c = 25.016 (21) Å, α = 93.13 (4), β = 103.24 (4), γ = 86.28 (2)° , U = 3597.5 Å3, Z = 2, μ = 0.080mm-1, Dm = 1.116, Dx = 1.119 Mg m-3. The final R value is 0.078 for 3329 independent reflexions. By assuming an average spherical shape for the tri-o-thymotide (TOT) molecules, the crystal structure can be visualized as a distorted non-closest hexagonal packing of spheres characterized by a periodic stacking of A and B layers. Each TOT molecule is surrounded by eight nearest neighbours. The benzene molecules are periodically distributed in three structurally different types of channels.

Citation (ISO format)
ALLEMAND, Jacques, GERDIL, Raymond. Structure cristallographique du clathrate triclinique tri-o-thymotide–benzène (2:2,5), 2C33H36O6.2,5C6H6. In: Acta crystallographica. Section C, Crystal structure communications, 1983, vol. 39, n° 2, p. 260–265. doi: 10.1107/S0108270183004333
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Journal ISSN0108-2701
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