Startseite Crystal and molecular structure of an isostere of purine ring system: 7-benzylamino-2-methylmercaptothiazolo [5,4-d] pyrimidine
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Crystal and molecular structure of an isostere of purine ring system: 7-benzylamino-2-methylmercaptothiazolo [5,4-d] pyrimidine

Veröffentlicht/Copyright: 25. August 2010
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Abstract

The crystal and molecular structure of the title compound has been established by means of the X-ray diffraction method on a single crystal using MoKα radiation. The crystals are monoclinic, space group P21/a with a = 8.745(2), b = 13.230(8), c = 11.729(2) Å, β = 94.06(2)°. The structure was solved by the heavy-atom method, and refined by full-matrix least squares to a final R value of 0.035 with 1787 ‘observed’ reflections. The five- and six-membered ring are planar and inclined to one another at 0.9°. In the five-membered ring the average C – S bond distance is 1.75 Å and the C – S – C angle is 87.9°.

Published Online: 2010-08-25
Published in Print: 1989

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